Federated Learning (FL) is a collaborative learning performed by a moderator that protects data privacy. Existing cross-silo FL solutions seldom address the absence of participating clients during training which can seriously degrade model performances, particularly for unbalanced and non-IID client data. We address this issue by generating secure data digests from the raw data and using them to guide model training at the FL moderator. The proposed FL with data digest (FedDig) framework can tolerate unexpected client absence while preserving data privacy. This is achieved by de-identifying digests by mixing and perturbing the encoded features of the raw data in the feature space. The feature perturbing is performed following the Laplace mechanism of Differential Privacy. We evaluate FedDig on EMNIST, CIFAR-10, and CIFAR-100 datasets. The results consistently outperform three baseline algorithms (FedAvg, FedProx, and FedNova) by large margins in multiple client absence scenarios.  ( 2 min )

Decentralized Actor-Critic (AC) algorithms have been widely utilized for multi-agent reinforcement learning (MARL) and have achieved remarkable success. Apart from its empirical success, the theoretical convergence property of decentralized AC algorithms is largely unexplored. Most of the existing finite-time convergence results are derived based on either double-loop update or two-timescale step sizes rule, and this is the case even for centralized AC algorithm under a single-agent setting. In practice, the \emph{single-timescale} update is widely utilized, where actor and critic are updated in an alternating manner with step sizes being of the same order. In this work, we study a decentralized \emph{single-timescale} AC algorithm.Theoretically, using linear approximation for value and reward estimation, we show that the algorithm has sample complexity of $\tilde{\mathcal{O}}(\varepsilon^{-2})$ under Markovian sampling, which matches the optimal complexity with a double-loop implementation (here, $\tilde{\mathcal{O}}$ hides a logarithmic term). When we reduce to the single-agent setting, our result yields new sample complexity for centralized AC using a single-timescale update scheme. The central to establishing our complexity results is \emph{the hidden smoothness of the optimal critic variable} we revealed. We also provide a local action privacy-preserving version of our algorithm and its analysis. Finally, we conduct experiments to show the superiority of our algorithm over the existing decentralized AC algorithms.  ( 2 min )

Optimal transport is an important tool in machine learning, allowing to capture geometric properties of the data through a linear program on transport polytopes. We present a single-loop optimization algorithm for minimizing general convex objectives on these domains, utilizing the principles of Sinkhorn matrix scaling and mirror descent. The proposed algorithm is robust to noise, and can be used in an online setting. We provide theoretical guarantees for convex objectives and experimental results showcasing it effectiveness on both synthetic and real-world data.

The prevalent communication efficient federated learning (FL) frameworks usually take advantages of model gradient compression or model distillation. However, the unbalanced local data distributions (either in quantity or quality) of participating clients, contributing non-equivalently to the global model training, still pose a big challenge to these works. In this paper, we propose FedCliP, a novel communication efficient FL framework that allows faster model training, by adaptively learning which clients should remain active for further model training and pruning those who should be inactive with less potential contributions. We also introduce an alternative optimization method with a newly defined contribution score measure to facilitate active and inactive client determination. We empirically evaluate the communication efficiency of FL frameworks with extensive experiments on three benchmark datasets under both IID and non-IID settings. Numerical results demonstrate the outperformance of the porposed FedCliP framework over state-of-the-art FL frameworks, i.e., FedCliP can save 70% of communication overhead with only 0.2% accuracy loss on MNIST datasets, and save 50% and 15% of communication overheads with less than 1% accuracy loss on FMNIST and CIFAR-10 datasets, respectively.  ( 2 min )

The design choices in the Transformer attention mechanism, including weak inductive bias and quadratic computational complexity, have limited its application for modeling long sequences. In this paper, we introduce Mega, a simple, theoretically grounded, single-head gated attention mechanism equipped with (exponential) moving average to incorporate inductive bias of position-aware local dependencies into the position-agnostic attention mechanism. We further propose a variant of Mega that offers linear time and space complexity yet yields only minimal quality loss, by efficiently splitting the whole sequence into multiple chunks with fixed length. Extensive experiments on a wide range of sequence modeling benchmarks, including the Long Range Arena, neural machine translation, auto-regressive language modeling, and image and speech classification, show that Mega achieves significant improvements over other sequence models, including variants of Transformers and recent state space models.  ( 2 min )

Training large neural networks is known to be time-consuming, with the learning duration taking days or even weeks. To address this problem, large-batch optimization was introduced. This approach demonstrated that scaling mini-batch sizes with appropriate learning rate adjustments can speed up the training process by orders of magnitude. While long training time was not typically a major issue for model-free deep offline RL algorithms, recently introduced Q-ensemble methods achieving state-of-the-art performance made this issue more relevant, notably extending the training duration. In this work, we demonstrate how this class of methods can benefit from large-batch optimization, which is commonly overlooked by the deep offline RL community. We show that scaling the mini-batch size and naively adjusting the learning rate allows for (1) a reduced size of the Q-ensemble, (2) stronger penalization of out-of-distribution actions, and (3) improved convergence time, effectively shortening training duration by 3-4x times on average.  ( 2 min )

We consider the problem of decision-making under uncertainty in an environment with safety constraints. Many business and industrial applications rely on real-time optimization to improve key performance indicators. In the case of unknown characteristics, real-time optimization becomes challenging, particularly because of the satisfaction of safety constraints. We propose the ARTEO algorithm, where we cast multi-armed bandits as a mathematical programming problem subject to safety constraints and learn the unknown characteristics through exploration while optimizing the targets. We quantify the uncertainty in unknown characteristics by using Gaussian processes and incorporate it into the cost function as a contribution which drives exploration. We adaptively control the size of this contribution in accordance with the requirements of the environment. We guarantee the safety of our algorithm with a high probability through confidence bounds constructed under the regularity assumptions of Gaussian processes. We demonstrate the safety and efficiency of our approach with two case studies: optimization of electric motor current and real-time bidding problems. We further evaluate the performance of ARTEO compared to a safe variant of upper confidence bound based algorithms. ARTEO achieves less cumulative regret with accurate and safe decisions.  ( 2 min )

In this paper, we study the bias of Stochastic Gradient Descent (SGD) to learn low-rank weight matrices when training deep ReLU neural networks. Our results show that training neural networks with mini-batch SGD and weight decay causes a bias towards rank minimization over the weight matrices. Specifically, we show, both theoretically and empirically, that this bias is more pronounced when using smaller batch sizes, higher learning rates, or increased weight decay. Additionally, we predict and observe empirically that weight decay is necessary to achieve this bias. Finally, we empirically investigate the connection between this bias and generalization, finding that it has a marginal effect on generalization. Our analysis is based on a minimal set of assumptions and applies to neural networks of any width or depth, including those with residual connections and convolutional layers.  ( 2 min )

Transformer models have recently gained popularity in graph representation learning as they have the potential to learn complex relationships beyond the ones captured by regular graph neural networks. The main research question is how to inject the structural bias of graphs into the transformer architecture, and several proposals have been made for undirected molecular graphs and, recently, also for larger network graphs. In this paper, we study transformers over directed acyclic graphs (DAGs) and propose architecture adaptations tailored to DAGs: (1) An attention mechanism that is more efficient than the regular quadratic complexity of transformers and at the same time faithfully captures the DAG structure, and (2) a positional encoding of the DAG's partial order, complementing the former. We rigorously evaluate our framework in ablation studies and show that it is effective in improving different kinds of baseline transformers over various types of data, in experiments ranging from classifying source code graphs to nodes in self-citation networks. In particular, our proposal makes (graph) transformers competitive to or outperform graph neural networks tailored to DAGs.  ( 2 min )

Real-world deployment of machine learning models is challenging when data evolves over time. And data does evolve over time. While no model can work when data evolves in an arbitrary fashion, if there is some pattern to these changes, we might be able to design methods to address it. This paper addresses situations when data evolves gradually. We introduce a novel time-varying importance weight estimator that can detect gradual shifts in the distribution of data. Such an importance weight estimator allows the training method to selectively sample past data -- not just similar data from the past like a standard importance weight estimator would but also data that evolved in a similar fashion in the past. Our time-varying importance weight is quite general. We demonstrate different ways of implementing it that exploit some known structure in the evolution of data. We demonstrate and evaluate this approach on a variety of problems ranging from supervised learning tasks (multiple image classification datasets) where the data undergoes a sequence of gradual shifts of our design to reinforcement learning tasks (robotic manipulation and continuous control) where data undergoes a shift organically as the policy or the task changes.

In this study, we aim to explore efficient tuning methods for speech self-supervised learning. Recent studies show that self-supervised learning (SSL) can learn powerful representations for different speech tasks. However, fine-tuning pre-trained models for each downstream task is parameter-inefficient since SSL models are notoriously large with millions of parameters. Adapters are lightweight modules commonly used in NLP to solve this problem. In downstream tasks, the parameters of SSL models are frozen, and only the adapters are trained. Given the lack of studies generally exploring the effectiveness of adapters for self-supervised speech tasks, we intend to fill this gap by adding various adapter modules in pre-trained speech SSL models. We show that the performance parity can be achieved with over 90% parameter reduction, and discussed the pros and cons of efficient tuning techniques. This is the first comprehensive investigation of various adapter types across speech tasks.

Large pre-trained models decay over long-term deployment as input distributions shift, user requirements change, or crucial knowledge gaps are discovered. Recently, model editors have been proposed to modify a model's behavior by adjusting its weights during deployment. However, when editing the same model multiple times, these approaches quickly decay a model's performance on upstream data and forget how to fix previous errors. We propose and study a novel Lifelong Model Editing setting, where streaming errors are identified for a deployed model and we update the model to correct its predictions without influencing unrelated inputs without access to training edits, exogenous datasets, or any upstream data for the edited model. To approach this problem, we introduce General Retrieval Adaptors for Continual Editing, or GRACE, which learns to cache a chosen layer's activations in an adaptive codebook as edits stream in, leaving original model weights frozen. GRACE can thus edit models thousands of times in a row using only streaming errors, without influencing unrelated inputs. Experimentally, we show that GRACE improves over recent alternatives and generalizes to unseen inputs. Our code is available at https://www.github.com/thartvigsen/grace.

This work presents mixed variational flows (MixFlows), a new variational family that consists of a mixture of repeated applications of a map to an initial reference distribution. First, we provide efficient algorithms for i.i.d. sampling, density evaluation, and unbiased ELBO estimation. We then show that MixFlows have MCMC-like convergence guarantees when the flow map is ergodic and measure-preserving, and provide bounds on the accumulation of error for practical implementations where the flow map is approximated. Finally, we develop an implementation of MixFlows based on uncorrected discretized Hamiltonian dynamics combined with deterministic momentum refreshment. Simulated and real data experiments show that MixFlows can provide more reliable posterior approximations than several black-box normalizing flows, as well as samples of comparable quality to those obtained from state-of-the-art MCMC methods.

Characterizing the implicit structure of the computation within neural networks is a foundational problem in the area of deep learning interpretability. Can the inner decision process of neural networks be captured symbolically in some familiar logic? We show that any fixed-precision transformer neural network can be translated into an equivalent fixed-size $\mathsf{FO}(\mathsf{M})$ formula, i.e., a first-order logic formula that, in addition to standard universal and existential quantifiers, may also contain majority-vote quantifiers. The proof idea is to design highly uniform boolean threshold circuits that can simulate transformers, and then leverage known theoretical connections between circuits and logic. Our results reveal a surprisingly simple formalism for capturing the behavior of transformers, show that simple problems like integer division are "transformer-hard", and provide valuable insights for comparing transformers to other models like RNNs. Our results suggest that first-order logic with majority may be a useful language for expressing programs extracted from transformers.

The thalamus is a subcortical gray matter structure that plays a key role in relaying sensory and motor signals within the brain. Its nuclei can atrophy or otherwise be affected by neurological disease and injuries including mild traumatic brain injury. Segmenting both the thalamus and its nuclei is challenging because of the relatively low contrast within and around the thalamus in conventional magnetic resonance (MR) images. This paper explores imaging features to determine key tissue signatures that naturally cluster, from which we can parcellate thalamic nuclei. Tissue contrasts include T1-weighted and T2-weighted images, MR diffusion measurements including FA, mean diffusivity, Knutsson coefficients that represent fiber orientation, and synthetic multi-TI images derived from FGATIR and T1-weighted images. After registration of these contrasts and isolation of the thalamus, we use the uniform manifold approximation and projection (UMAP) method for dimensionality reduction to produce a low-dimensional representation of the data within the thalamus. Manual labeling of the thalamus provides labels for our UMAP embedding from which k nearest neighbors can be used to label new unseen voxels in that same UMAP embedding. N -fold cross-validation of the method reveals comparable performance to state-of-the-art methods for thalamic parcellation.

A practical issue of edge AI systems is that data distributions of trained dataset and deployed environment may differ due to noise and environmental changes over time. Such a phenomenon is known as a concept drift, and this gap degrades the performance of edge AI systems and may introduce system failures. To address this gap, retraining of neural network models triggered by concept drift detection is a practical approach. However, since available compute resources are strictly limited in edge devices, in this paper we propose a fully sequential concept drift detection method in cooperation with an on-device sequential learning technique of neural networks. In this case, both the neural network retraining and the proposed concept drift detection are done only by sequential computation to reduce computation cost and memory utilization. Evaluation results of the proposed approach shows that while the accuracy is decreased by 3.8%-4.3% compared to existing batch-based detection methods, it decreases the memory size by 88.9%-96.4% and the execution time by 1.3%-83.8%. As a result, the combination of the neural network retraining and the proposed concept drift detection method is demonstrated on Raspberry Pi Pico that has 264kB memory.

Many phenomena from physics and engineering require highly flexible models, and have ample data with which to fit. However, this data is often irregularly sampled, and cannot be processed as it is by standard deep learning architecture. We propose a transformer-based model for forecasting physical processes at arbitrary spatial points given information on a related process at possibly different points. This architecture is particularly well-suited for high-altitude wind forecasting, as it can effectively leverage large volumes of data recorded along plane trajectories, which are sparse in space. We test at different scales for two different dynamical systems previously studied in the literature: the Poisson equation and Darcy Flow equation. In both cases, our transformer-based model outperforms alternative methods. We hypothesize that this superior performance is due to a more flexible latent representation. To support this hypothesis, we design a simple synthetic experiment to show that the latent representation of the other models suffers from excessive bottlenecking that is, in some cases, preventing the efficient use of the information and slowing training.

We present a fast, differentially private algorithm for high-dimensional covariance-aware mean estimation with nearly optimal sample complexity. Only exponential-time estimators were previously known to achieve this guarantee. Given $n$ samples from a (sub-)Gaussian distribution with unknown mean $\mu$ and covariance $\Sigma$, our $(\varepsilon,\delta)$-differentially private estimator produces $\tilde{\mu}$ such that $\|\mu - \tilde{\mu}\|_{\Sigma} \leq \alpha$ as long as $n \gtrsim \tfrac d {\alpha^2} + \tfrac{d \sqrt{\log 1/\delta}}{\alpha \varepsilon}+\frac{d\log 1/\delta}{\varepsilon}$. The Mahalanobis error metric $\|\mu - \hat{\mu}\|_{\Sigma}$ measures the distance between $\hat \mu$ and $\mu$ relative to $\Sigma$; it characterizes the error of the sample mean. Our algorithm runs in time $\tilde{O}(nd^{\omega - 1} + nd/\varepsilon)$, where $\omega < 2.38$ is the matrix multiplication exponent. We adapt an exponential-time approach of Brown, Gaboardi, Smith, Ullman, and Zakynthinou (2021), giving efficient variants of stable mean and covariance estimation subroutines that also improve the sample complexity to the nearly optimal bound above. Our stable covariance estimator can be turned to private covariance estimation for unrestricted subgaussian distributions. With $n\gtrsim d^{3/2}$ samples, our estimate is accurate in spectral norm. This is the first such algorithm using $n= o(d^2)$ samples, answering an open question posed by Alabi et al. (2022). With $n\gtrsim d^2$ samples, our estimate is accurate in Frobenius norm. This leads to a fast, nearly optimal algorithm for private learning of unrestricted Gaussian distributions in TV distance. Duchi, Haque, and Kuditipudi (2023) obtained similar results independently and concurrently.  ( 2 min )

We study high-probability regret bounds for adversarial $K$-armed bandits with time-varying feedback graphs over $T$ rounds. For general strongly observable graphs, we develop an algorithm that achieves the optimal regret $\widetilde{\mathcal{O}}((\sum_{t=1}^T\alpha_t)^{1/2}+\max_{t\in[T]}\alpha_t)$ with high probability, where $\alpha_t$ is the independence number of the feedback graph at round $t$. Compared to the best existing result [Neu, 2015] which only considers graphs with self-loops for all nodes, our result not only holds more generally, but importantly also removes any $\text{poly}(K)$ dependence that can be prohibitively large for applications such as contextual bandits. Furthermore, we also develop the first algorithm that achieves the optimal high-probability regret bound for weakly observable graphs, which even improves the best expected regret bound of [Alon et al., 2015] by removing the $\mathcal{O}(\sqrt{KT})$ term with a refined analysis. Our algorithms are based on the online mirror descent framework, but importantly with an innovative combination of several techniques. Notably, while earlier works use optimistic biased loss estimators for achieving high-probability bounds, we find it important to use a pessimistic one for nodes without self-loop in a strongly observable graph.

As humanity has begun to explore space, the significance of space weather has become apparent. It has been established that coronal holes, a type of space weather phenomenon, can impact the operation of aircraft and satellites. The coronal hole is an area on the sun characterized by open magnetic field lines and relatively low temperatures, which result in the emission of the solar wind at higher than average rates. In this study, To prepare for the impact of coronal holes on the Earth, we use computer vision to detect the coronal hole region and calculate its size based on images from the Solar Dynamics Observatory (SDO). We then implement deep learning techniques, specifically the Long Short-Term Memory (LSTM) method, to analyze trends in the coronal hole area data and predict its size for different sun regions over 7 days. By analyzing time series data on the coronal hole area, this study aims to identify patterns and trends in coronal hole behavior and understand how they may impact space weather events. This research represents an important step towards improving our ability to predict and prepare for space weather events that can affect Earth and technological systems.

With increasingly more computation being shifted to the edge of the network, monitoring of critical infrastructures, such as intermediate processing nodes in autonomous driving, is further complicated due to the typically resource-constrained environments. In order to reduce the resource overhead on the network link imposed by monitoring, various methods have been discussed that either follow a filtering approach for data-emitting devices or conduct dynamic sampling based on employed prediction models. Still, existing methods are mainly requiring adaptive monitoring on edge devices, which demands device reconfigurations, utilizes additional resources, and limits the sophistication of employed models. In this paper, we propose a sampling-based and cloud-located approach that internally utilizes probabilistic forecasts and hence provides means of quantifying model uncertainties, which can be used for contextualized adaptations of sampling frequencies and consequently relieves constrained network resources. We evaluate our prototype implementation for the monitoring pipeline on a publicly available streaming dataset and demonstrate its positive impact on resource efficiency in a method comparison.  ( 2 min )

High dimensional data for classification does create many difficulties for machine learning algorithms. The generalization can be done using ensemble learning methods such as bagging based supervised non-parametric random forest algorithm. In this paper we solve the problem of binary classification for high dimensional data using random forest for polycystic ovary syndrome dataset. We have performed the implementation and provided a detailed visualization of the data for general inference. The training accuracy that we have achieved is 95.6% and validation accuracy over 91.74% respectively.

Deep Ensembles, as a type of Bayesian Neural Networks, can be used to estimate uncertainty on the prediction of multiple neural networks by collecting votes from each network and computing the difference in those predictions. In this paper, we introduce a method for uncertainty estimation that considers a set of independent categorical distributions for each layer of the network, giving many more possible samples with overlapped layers than in the regular Deep Ensembles. We further introduce an optimized inference procedure that reuses common layer outputs, achieving up to 19x speed up and reducing memory usage quadratically. We also show that the method can be further improved by ranking samples, resulting in models that require less memory and time to run while achieving higher uncertainty quality than Deep Ensembles.

The potential market for modern self-driving cars is enormous, as they are developing remarkably rapidly. At the same time, however, cases of pedestrian fatalities caused by autonomous driving have been recorded in the case of crossing the road. In this paper, we propose level-$k$ thinking into MAML to create a Level-$k$ Meta Reinforcement Learning (LK-MRL) as a self-driving vehicle model to prepare for heterogeneous pedestrians and improve intersection safety based on the combination of meta reinforcement learning and human cognitive hierarchy framework. In our evaluation, we assign this model to two different cognitive confrontation hierarchy scenarios in an urban traffic simulator to show not only its demonstrate its advantage in road safety but also the producing ability of higher-level thinking strategies.

It is a growing direction to utilize unintended memorization in ML models to benefit real-world applications, with recent efforts like user auditing, dataset ownership inference and forgotten data measurement. Standing on the point of ML model development, we introduce a process named data origin inference, to assist ML developers in locating missed or faulty data origin in training set without maintaining strenuous metadata. We formally define the data origin and the data origin inference task in the development of the ML model (mainly neural networks). Then we propose a novel inference strategy combining embedded-space multiple instance classification and shadow training. Diverse use cases cover language, visual and structured data, with various kinds of data origin (e.g. business, county, movie, mobile user, text author). A comprehensive performance analysis of our proposed strategy contains referenced target model layers, available testing data for each origin, and in shadow training, the implementations of feature extraction as well as shadow models. Our best inference accuracy achieves 98.96% in the language use case when the target model is a transformer-based deep neural network. Furthermore, we give a statistical analysis of different kinds of data origin to investigate what kind of origin is probably to be inferred correctly.

State-of-the-art performance in electroencephalography (EEG) decoding tasks is currently often achieved with either Deep-Learning or Riemannian-Geometry-based decoders. Recently, there is growing interest in Deep Riemannian Networks (DRNs) possibly combining the advantages of both previous classes of methods. However, there are still a range of topics where additional insight is needed to pave the way for a more widespread application of DRNs in EEG. These include architecture design questions such as network size and end-to-end ability as well as model training questions. How these factors affect model performance has not been explored. Additionally, it is not clear how the data within these networks is transformed, and whether this would correlate with traditional EEG decoding. Our study aims to lay the groundwork in the area of these topics through the analysis of DRNs for EEG with a wide range of hyperparameters. Networks were tested on two public EEG datasets and compared with state-of-the-art ConvNets. Here we propose end-to-end EEG SPDNet (EE(G)-SPDNet), and we show that this wide, end-to-end DRN can outperform the ConvNets, and in doing so use physiologically plausible frequency regions. We also show that the end-to-end approach learns more complex filters than traditional band-pass filters targeting the classical alpha, beta, and gamma frequency bands of the EEG, and that performance can benefit from channel specific filtering approaches. Additionally, architectural analysis revealed areas for further improvement due to the possible loss of Riemannian specific information throughout the network. Our study thus shows how to design and train DRNs to infer task-related information from the raw EEG without the need of handcrafted filterbanks and highlights the potential of end-to-end DRNs such as EE(G)-SPDNet for high-performance EEG decoding.

Models that can predict the occurrence of events ahead of time with low false-alarm rates are critical to the acceptance of decision support systems in the medical community. This challenging task is typically treated as a simple binary classification, ignoring temporal dependencies between samples, whereas we propose to exploit this structure. We first introduce a common theoretical framework unifying dynamic survival analysis and early event prediction. Following an analysis of objectives from both fields, we propose Temporal Label Smoothing (TLS), a simpler, yet best-performing method that preserves prediction monotonicity over time. By focusing the objective on areas with a stronger predictive signal, TLS improves performance over all baselines on two large-scale benchmark tasks. Gains are particularly notable along clinically relevant measures, such as event recall at low false-alarm rates. TLS reduces the number of missed events by up to a factor of two over previously used approaches in early event prediction.  ( 2 min )

A key problem in network theory is how to reconfigure a graph in order to optimize a quantifiable objective. Given the ubiquity of networked systems, such work has broad practical applications in a variety of situations, ranging from drug and material design to telecommunications. The large decision space of possible reconfigurations, however, makes this problem computationally intensive. In this paper, we cast the problem of network rewiring for optimizing a specified structural property as a Markov Decision Process (MDP), in which a decision-maker is given a budget of modifications that are performed sequentially. We then propose a general approach based on the Deep Q-Network (DQN) algorithm and graph neural networks (GNNs) that can efficiently learn strategies for rewiring networks. We then discuss a cybersecurity case study, i.e., an application to the computer network reconfiguration problem for intrusion protection. In a typical scenario, an attacker might have a (partial) map of the system they plan to penetrate; if the network is effectively "scrambled", they would not be able to navigate it since their prior knowledge would become obsolete. This can be viewed as an entropy maximization problem, in which the goal is to increase the surprise of the network. Indeed, entropy acts as a proxy measurement of the difficulty of navigating the network topology. We demonstrate the general ability of the proposed method to obtain better entropy gains than random rewiring on synthetic and real-world graphs while being computationally inexpensive, as well as being able to generalize to larger graphs than those seen during training. Simulations of attack scenarios confirm the effectiveness of the learned rewiring strategies.  ( 3 min )

Agent-Based Models are very useful for simulation of physical or social processes, such as the spreading of a pandemic in a city. Such models proceed by specifying the behavior of individuals (agents) and their interactions, and parameterizing the process of infection based on such interactions based on the geography and demography of the city. However, such models are computationally very expensive, and the complexity is often linear in the total number of agents. This seriously limits the usage of such models for simulations, which often have to be run hundreds of times for policy planning and even model parameter estimation. An alternative is to develop an emulator, a surrogate model that can predict the Agent-Based Simulator's output based on its initial conditions and parameters. In this paper, we discuss a Deep Learning model based on Dilated Convolutional Neural Network that can emulate such an agent based model with high accuracy. We show that use of this model instead of the original Agent-Based Model provides us major gains in the speed of simulations, allowing much quicker calibration to observations, and more extensive scenario analysis. The models we consider are spatially explicit, as the locations of the infected individuals are simulated instead of the gross counts. Another aspect of our emulation framework is its divide-and-conquer approach that divides the city into several small overlapping blocks and carries out the emulation in them parallelly, after which these results are merged together. This ensures that the same emulator can work for a city of any size, and also provides significant improvement of time complexity of the emulator, compared to the original simulator.  ( 2 min )

Bilevel optimization recently has attracted increased interest in machine learning due to its many applications such as hyper-parameter optimization and meta learning. Although many bilevel optimization methods recently have been proposed, these methods do not consider using adaptive learning rates. It is well known that adaptive learning rates can accelerate many optimization algorithms including (stochastic) gradient-based algorithms. To fill this gap, in the paper, we propose a novel fast adaptive bilevel framework to solve stochastic bilevel optimization problems that the outer problem is possibly nonconvex and the inner problem is strongly convex. Our framework uses unified adaptive matrices including many types of adaptive learning rates, and can flexibly use the momentum and variance reduced techniques. In particular, we provide a useful convergence analysis framework for the bilevel optimization. Specifically, we propose a fast single-loop adaptive bilevel optimization (BiAdam) algorithm based on the basic momentum technique, which achieves a sample complexity of $\tilde{O}(\epsilon^{-4})$ for finding an $\epsilon$-stationary solution (i.e., $\mathbb{E}\|\nabla F(x)\| \leq \epsilon$ or its equivalent variants). Meanwhile, we propose an accelerated version of BiAdam algorithm (VR-BiAdam) by using variance reduced technique, which reaches the best known sample complexity of $\tilde{O}(\epsilon^{-3})$ without relying on large batch-size. To the best of our knowledge, we first study the adaptive bilevel optimization methods with adaptive learning rates. Some experimental results on data hyper-cleaning and hyper-representation learning tasks demonstrate the efficiency of our algorithms.  ( 2 min )

Inferencing unlabeled data from labeled data is an error-prone process. Conventional neural network training is highly sensitive to supervision errors. These two realities make semi-supervised learning (SSL) troublesome. In practice, SSL approaches often fail to outperform their fully supervised baseline. Proposed is a novel framework for deep SSL via transductive pseudo-label refinement called Contrastive Credibility Propagation (CCP). Through an iterative process of refining soft pseudo-labels, CCP unifies a novel contrastive approach for generating pseudo-labels and a powerful technique to overcome instance-dependent label noise. The result is an SSL classification framework explicitly designed to overcome inevitable pseudo-label errors. Using standard text and image benchmark classification datasets, we show CCP reliably boosts or matches performance over a supervised baseline in four common real-world SSL scenarios: few-label, open-set, noisy-label, and class distribution misalignment.  ( 2 min )

The last decade of machine learning has seen drastic increases in scale and capabilities. Deep neural networks (DNNs) are increasingly being deployed in the real world. However, they are difficult to analyze, raising concerns about using them without a rigorous understanding of how they function. Effective tools for interpreting them will be important for building more trustworthy AI by helping to identify problems, fix bugs, and improve basic understanding. In particular, "inner" interpretability techniques, which focus on explaining the internal components of DNNs, are well-suited for developing a mechanistic understanding, guiding manual modifications, and reverse engineering solutions. Much recent work has focused on DNN interpretability, and rapid progress has thus far made a thorough systematization of methods difficult. In this survey, we review over 300 works with a focus on inner interpretability tools. We introduce a taxonomy that classifies methods by what part of the network they help to explain (weights, neurons, subnetworks, or latent representations) and whether they are implemented during (intrinsic) or after (post hoc) training. To our knowledge, we are also the first to survey a number of connections between interpretability research and work in adversarial robustness, continual learning, modularity, network compression, and studying the human visual system. We discuss key challenges and argue that the status quo in interpretability research is largely unproductive. Finally, we highlight the importance of future work that emphasizes diagnostics, debugging, adversaries, and benchmarking in order to make interpretability tools more useful to engineers in practical applications.  ( 3 min )

Large Language Models (LLMs) have been reported to have strong performance on natural language processing tasks. However, performance metrics such as accuracy do not measure the quality of the model in terms of its ability to robustly represent complex linguistic structure. In this work, we propose a framework and measure of robustness to assess the consistency of linguistic representations against syntax-preserving perturbations. We leverage recent advances in extracting linguistic constructs from LLMs to test the robustness of such structures. Empirically, we study the performance of four LLMs across six different corpora on the proposed robustness measures. We provide evidence that context-free representation (e.g., GloVe) are in some cases competitive with context-dependent representations from modern LLMs (e.g., BERT), yet equally brittle to syntax-preserving manipulations. Emergent syntactic representations in neural networks are brittle, thus our work poses the attention on the risk of comparing such structures to those that are object of a long lasting debate in linguistics.

We developed an inherently interpretable multilevel Bayesian framework for representing variation in regression coefficients that mimics the piecewise linearity of ReLU-activated deep neural networks. We used the framework to formulate a survival model for using medical claims to predict hospital readmission and death that focuses on discharge placement, adjusting for confounding in estimating causal local average treatment effects. We trained the model on a 5% sample of Medicare beneficiaries from 2008 and 2011, based on their 2009--2011 inpatient episodes, and then tested the model on 2012 episodes. The model scored an AUROC of approximately 0.76 on predicting all-cause readmissions -- defined using official Centers for Medicare and Medicaid Services (CMS) methodology -- or death within 30-days of discharge, being competitive against XGBoost and a Bayesian deep neural network, demonstrating that one need-not sacrifice interpretability for accuracy. Crucially, as a regression model, we provide what blackboxes cannot -- the exact gold-standard global interpretation of the model, identifying relative risk factors and quantifying the effect of discharge placement. We also show that the posthoc explainer SHAP fails to provide accurate explanations.  ( 2 min )

Cell-free massive MIMO is emerging as a promising technology for future wireless communication systems, which is expected to offer uniform coverage and high spectral efficiency compared to classical cellular systems. We study in this paper how cell-free massive MIMO can support federated edge learning. Taking advantage of the additive nature of the wireless multiple access channel, over-the-air computation is exploited, where the clients send their local updates simultaneously over the same communication resource. This approach, known as over-the-air federated learning (OTA-FL), is proven to alleviate the communication overhead of federated learning over wireless networks. Considering channel correlation and only imperfect channel state information available at the central server, we propose a practical implementation of OTA-FL over cell-free massive MIMO. The convergence of the proposed implementation is studied analytically and experimentally, confirming the benefits of cell-free massive MIMO for OTA-FL.

Predicting discrete events in time and space has many scientific applications, such as predicting hazardous earthquakes and outbreaks of infectious diseases. History-dependent spatio-temporal Hawkes processes are often used to mathematically model these point events. However, previous approaches have faced numerous challenges, particularly when attempting to forecast one or multiple future events. In this work, we propose a new neural architecture for simultaneous multi-event forecasting of spatio-temporal point processes, utilizing transformers, augmented with normalizing flows and probabilistic layers. Our network makes batched predictions of complex history-dependent spatio-temporal distributions of future discrete events, achieving state-of-the-art performance on a variety of benchmark datasets including the South California Earthquakes, Citibike, Covid-19, and Hawkes synthetic pinwheel datasets. More generally, we illustrate how our network can be applied to any dataset of discrete events with associated markers, even when no underlying physics is known.

Typical representations for arbitrary-oriented object detection tasks include oriented bounding box (OBB), quadrilateral bounding box (QBB), and point set (PointSet). Each representation encounters problems that correspond to its characteristics, such as the boundary discontinuity, square-like problem, representation ambiguity, and isolated points, which lead to inaccurate detection. Although many effective strategies have been proposed for various representations, there is still no unified solution. Current detection methods based on Gaussian modeling have demonstrated the possibility of breaking this dilemma; however, they remain limited to OBB. To go further, in this paper, we propose a unified Gaussian representation called G-Rep to construct Gaussian distributions for OBB, QBB, and PointSet, which achieves a unified solution to various representations and problems. Specifically, PointSet or QBB-based object representations are converted into Gaussian distributions, and their parameters are optimized using the maximum likelihood estimation algorithm. Then, three optional Gaussian metrics are explored to optimize the regression loss of the detector because of their excellent parameter optimization mechanisms. Furthermore, we also use Gaussian metrics for sampling to align label assignment and regression loss. Experimental results on several public available datasets, such as DOTA, HRSC2016, UCAS-AOD, and ICDAR2015, show the excellent performance of the proposed method for arbitrary-oriented object detection.

Graph Neural Networks (GNNs) have shown expressive performance on graph representation learning by aggregating information from neighbors. Recently, some studies have discussed the importance of modeling neighborhood distribution on the graph. However, most existing GNNs aggregate neighbors' features through single statistic (e.g., mean, max, sum), which loses the information related to neighbor's feature distribution and therefore degrades the model performance. In this paper, inspired by the method of moment in statistical theory, we propose to model neighbor's feature distribution with multi-order moments. We design a novel GNN model, namely Mix-Moment Graph Neural Network (MM-GNN), which includes a Multi-order Moment Embedding (MME) module and an Element-wise Attention-based Moment Adaptor module. MM-GNN first calculates the multi-order moments of the neighbors for each node as signatures, and then use an Element-wise Attention-based Moment Adaptor to assign larger weights to important moments for each node and update node representations. We conduct extensive experiments on 15 real-world graphs (including social networks, citation networks and web-page networks etc.) to evaluate our model, and the results demonstrate the superiority of MM-GNN over existing state-of-the-art models.

We introduce a framework for automatically defining and learning deep generative models with problem-specific structure. We tackle problem domains that are more traditionally solved by algorithms such as sorting, constraint satisfaction for Sudoku, and matrix factorization. Concretely, we train diffusion models with an architecture tailored to the problem specification. This problem specification should contain a graphical model describing relationships between variables, and often benefits from explicit representation of subcomputations. Permutation invariances can also be exploited. Across a diverse set of experiments we improve the scaling relationship between problem dimension and our model's performance, in terms of both training time and final accuracy.  ( 2 min )

Transformers have achieved great success in several domains, including Natural Language Processing and Computer Vision. However, its application to real-world graphs is less explored, mainly due to its high computation cost and its poor generalizability caused by the lack of enough training data in the graph domain. To fill in this gap, we propose a scalable Transformer-like dynamic graph learning method named Dynamic Graph Transformer (DyFormer) with spatial-temporal encoding to effectively learn graph topology and capture implicit links. To achieve efficient and scalable training, we propose temporal-union graph structure and its associated subgraph-based node sampling strategy. To improve the generalization ability, we introduce two complementary self-supervised pre-training tasks and show that jointly optimizing the two pre-training tasks results in a smaller Bayesian error rate via an information-theoretic analysis. Extensive experiments on the real-world datasets illustrate that DyFormer achieves a consistent 1%-3% AUC gain (averaged over all time steps) compared with baselines on all benchmarks.  ( 2 min )

Causal discovery, the inference of causal relations from data, is a core task of fundamental importance in all scientific domains, and several new machine learning methods for addressing the causal discovery problem have been proposed recently. However, existing machine learning methods for causal discovery typically require that the data used for inference is pooled and available in a centralized location. In many domains of high practical importance, such as in healthcare, data is only available at local data-generating entities (e.g. hospitals in the healthcare context), and cannot be shared across entities due to, among others, privacy and regulatory reasons. In this work, we address the problem of inferring causal structure - in the form of a directed acyclic graph (DAG) - from a distributed data set that contains both observational and interventional data in a privacy-preserving manner by exchanging updates instead of samples. To this end, we introduce a new federated framework, FED-CD, that enables the discovery of global causal structures both when the set of intervened covariates is the same across decentralized entities, and when the set of intervened covariates are potentially disjoint. We perform a comprehensive experimental evaluation on synthetic data that demonstrates that FED-CD enables effective aggregation of decentralized data for causal discovery without direct sample sharing, even when the contributing distributed data sets cover disjoint sets of interventions. Effective methods for causal discovery in distributed data sets could significantly advance scientific discovery and knowledge sharing in important settings, for instance, healthcare, in which sharing of data across local sites is difficult or prohibited.  ( 2 min )

To address the bias exhibited by machine learning models, fairness criteria impose statistical constraints for ensuring equal treatment to all demographic groups, but typically at a cost to model performance. Understanding this tradeoff, therefore, underlies the design of fair and effective algorithms. This paper completes the characterization of the inherent tradeoff of demographic parity on classification problems in the most general multigroup, multiclass, and noisy setting. Specifically, we show that the minimum error rate is given by the optimal value of a Wasserstein-barycenter problem. More practically, this reformulation leads to a simple procedure for post-processing any pre-trained predictors to satisfy demographic parity in the general setting, which, in particular, yields the optimal fair classifier when applied to the Bayes predictor. We provide suboptimality and finite sample analyses for our procedure, and demonstrate precise control of the tradeoff of error rate for fairness on real-world datasets provided sufficient data.  ( 2 min )

Graph Neural Networks (GNNs) had been demonstrated to be inherently susceptible to the problems of over-smoothing and over-squashing. These issues prohibit the ability of GNNs to model complex graph interactions by limiting their effectiveness in taking into account distant information. Our study reveals the key connection between the local graph geometry and the occurrence of both of these issues, thereby providing a unified framework for studying them at a local scale using the Ollivier-Ricci curvature. Specifically, we demonstrate that over-smoothing is linked to positive graph curvature, while over-squashing is linked to negative graph curvature. Based on our theory, we propose the Batch Ollivier-Ricci Flow, a novel rewiring algorithm capable of simultaneously addressing both over-smoothing and over-squashing.

Contrastive deep graph clustering, which aims to divide nodes into disjoint groups via contrastive mechanisms, is a challenging research spot. Among the recent works, hard sample mining-based algorithms have achieved great attention for their promising performance. However, we find that the existing hard sample mining methods have two problems as follows. 1) In the hardness measurement, the important structural information is overlooked for similarity calculation, degrading the representativeness of the selected hard negative samples. 2) Previous works merely focus on the hard negative sample pairs while neglecting the hard positive sample pairs. Nevertheless, samples within the same cluster but with low similarity should also be carefully learned. To solve the problems, we propose a novel contrastive deep graph clustering method dubbed Hard Sample Aware Network (HSAN) by introducing a comprehensive similarity measure criterion and a general dynamic sample weighing strategy. Concretely, in our algorithm, the similarities between samples are calculated by considering both the attribute embeddings and the structure embeddings, better revealing sample relationships and assisting hardness measurement. Moreover, under the guidance of the carefully collected high-confidence clustering information, our proposed weight modulating function will first recognize the positive and negative samples and then dynamically up-weight the hard sample pairs while down-weighting the easy ones. In this way, our method can mine not only the hard negative samples but also the hard positive sample, thus improving the discriminative capability of the samples further. Extensive experiments and analyses demonstrate the superiority and effectiveness of our proposed method.

The accelerated use of digital cameras prompts an increasing concern about privacy and security, particularly in applications such as action recognition. In this paper, we propose an optimizing framework to provide robust visual privacy protection along the human action recognition pipeline. Our framework parameterizes the camera lens to successfully degrade the quality of the videos to inhibit privacy attributes and protect against adversarial attacks while maintaining relevant features for activity recognition. We validate our approach with extensive simulations and hardware experiments.

Over past few years afterward the birth of ResNet, skip connection has become the defacto standard for the design of modern architectures due to its widespread adoption, easy optimization and proven performance. Prior work has explained the effectiveness of the skip connection mechanism from different perspectives. In this work, we deep dive into the model's behaviors with skip connections which can be formulated as a learnable Markov chain. An efficient Markov chain is preferred as it always maps the input data to the target domain in a better way. However, while a model is explained as a Markov chain, it is not guaranteed to be optimized following an efficient Markov chain by existing SGD-based optimizers which are prone to get trapped in local optimal points. In order to towards a more efficient Markov chain, we propose a simple routine of penal connection to make any residual-like model become a learnable Markov chain. Aside from that, the penal connection can also be viewed as a particular model regularization and can be easily implemented with one line of code in the most popular deep learning frameworks~\footnote{Source code: \url{https://github.com/densechen/penal-connection}}. The encouraging experimental results in multi-modal translation and image recognition empirically confirm our conjecture of the learnable Markov chain view and demonstrate the superiority of the proposed penal connection.

A growing body of literature in fairness-aware ML (fairML) aspires to mitigate machine learning (ML)-related unfairness in automated decision making (ADM) by defining metrics that measure fairness of an ML model and by proposing methods that ensure that trained ML models achieve low values in those measures. However, the underlying concept of fairness, i.e., the question of what fairness is, is rarely discussed, leaving a considerable gap between centuries of philosophical discussion and recent adoption of the concept in the ML community. In this work, we try to bridge this gap by formalizing a consistent concept of fairness and by translating the philosophical considerations into a formal framework for the training and evaluation of ML models in ADM systems. We derive that fairness problems can already arise without the presence of protected attributes, pointing out that fairness and predictive performance are not irreconcilable counterparts, but rather that the latter is necessary to achieve the former. Moreover, we argue why and how causal considerations are necessary when assessing fairness in the presence of protected attributes. We achieve greater linguistic clarity for the discussion of fairML and propose general algorithms for practical applications.

Equilibrium Propagation (EP) is a powerful and more bio-plausible alternative to conventional learning frameworks such as backpropagation. The effectiveness of EP stems from the fact that it relies only on local computations and requires solely one kind of computational unit during both of its training phases, thereby enabling greater applicability in domains such as bio-inspired neuromorphic computing. The dynamics of the model in EP is governed by an energy function and the internal states of the model consequently converge to a steady state following the state transition rules defined by the same. However, by definition, EP requires the input to the model (a convergent RNN) to be static in both the phases of training. Thus it is not possible to design a model for sequence classification using EP with an LSTM or GRU like architecture. In this paper, we leverage recent developments in modern hopfield networks to further understand energy based models and develop solutions for complex sequence classification tasks using EP while satisfying its convergence criteria and maintaining its theoretical similarities with recurrent backpropagation. We explore the possibility of integrating modern hopfield networks as an attention mechanism with convergent RNN models used in EP, thereby extending its applicability for the first time on two different sequence classification tasks in natural language processing viz. sentiment analysis (IMDB dataset) and natural language inference (SNLI dataset).

Personalization of machine learning (ML) predictions for individual users/domains/enterprises is critical for practical recommendation style systems. Standard personalization approaches involve learning a user/domain specific embedding that is fed into a fixed global model which can be limiting. On the other hand, personalizing/fine-tuning model itself for each user/domain -- a.k.a meta-learning -- has high storage/infrastructure cost. We propose a novel meta-learning style approach that models network weights as a sum of low-rank and sparse matrices. This captures common information from multiple individuals/users together in the low-rank part while sparse part captures user-specific idiosyncrasies. Furthermore, the framework is up to two orders of magnitude more scalable (in terms of storage/infrastructure cost) than user-specific finetuning of model. We then study the framework in the linear setting, where the problem reduces to that of estimating the sum of a rank-$r$ and a $k$-column sparse matrix using a small number of linear measurements. We propose an alternating minimization method with iterative hard thresholding -- AMHT-LRS -- to learn the low-rank and sparse part. For the realizable, Gaussian data setting, we show that AMHT-LRS solves the problem efficiently with nearly optimal samples. A significant challenge in personalization is ensuring privacy of each user's sensitive data. We alleviate this problem by proposing a differentially private variant of our method that also is equipped with strong generalization guarantees. Finally, on multiple standard recommendation datasets, we demonstrate that our approach allows personalized models to obtain superior performance in sparse data regime.

Nonconvex optimization is central in solving many machine learning problems, in which block-wise structure is commonly encountered. In this work, we propose cyclic block coordinate methods for nonconvex optimization problems with non-asymptotic gradient norm guarantees. Our convergence analysis is based on a gradient Lipschitz condition with respect to a Mahalanobis norm, inspired by a recent progress on cyclic block coordinate methods. In deterministic settings, our convergence guarantee matches the guarantee of (full-gradient) gradient descent, but with the gradient Lipschitz constant being defined w.r.t.~a Mahalanobis norm. In stochastic settings, we use recursive variance reduction to decrease the per-iteration cost and match the arithmetic operation complexity of current optimal stochastic full-gradient methods, with a unified analysis for both finite-sum and infinite-sum cases. We prove a faster linear convergence result when a Polyak-{\L}ojasiewicz (P{\L}) condition holds. To our knowledge, this work is the first to provide non-asymptotic convergence guarantees -- variance-reduced or not -- for a cyclic block coordinate method in general composite (smooth + nonsmooth) nonconvex settings. Our experimental results demonstrate the efficacy of the proposed cyclic scheme in training deep neural nets.

Support vector machines (SVM) and other kernel techniques represent a family of powerful statistical classification methods with high accuracy and broad applicability. Because they use all or a significant portion of the training data, however, they can be slow, especially for large problems. Piecewise linear classifiers are similarly versatile, yet have the additional advantages of simplicity, ease of interpretation and, if the number of component linear classifiers is not too large, speed. Here we show how a simple, piecewise linear classifier can be trained from a kernel-based classifier in order to improve the classification speed. The method works by finding the root of the difference in conditional probabilities between pairs of opposite classes to build up a representation of the decision boundary. When tested on 17 different datasets, it succeeded in improving the classification speed of a SVM for 12 of them by up to two orders-of-magnitude. Of these, two were less accurate than a simple, linear classifier. The method is best suited to problems with continuum features data and smooth probability functions. Because the component linear classifiers are built up individually from an existing classifier, rather than through a simultaneous optimization procedure, the classifier is also fast to train.

This paper describes a deep reinforcement learning (DRL) approach that won Phase 1 of the Real Robot Challenge (RRC) 2021, and then extends this method to a more difficult manipulation task. The RRC consisted of using a TriFinger robot to manipulate a cube along a specified positional trajectory, but with no requirement for the cube to have any specific orientation. We used a relatively simple reward function, a combination of goal-based sparse reward and distance reward, in conjunction with Hindsight Experience Replay (HER) to guide the learning of the DRL agent (Deep Deterministic Policy Gradient (DDPG)). Our approach allowed our agents to acquire dexterous robotic manipulation strategies in simulation. These strategies were then applied to the real robot and outperformed all other competition submissions, including those using more traditional robotic control techniques, in the final evaluation stage of the RRC. Here we extend this method, by modifying the task of Phase 1 of the RRC to require the robot to maintain the cube in a particular orientation, while the cube is moved along the required positional trajectory. The requirement to also orient the cube makes the agent unable to learn the task through blind exploration due to increased problem complexity. To circumvent this issue, we make novel use of a Knowledge Transfer (KT) technique that allows the strategies learned by the agent in the original task (which was agnostic to cube orientation) to be transferred to this task (where orientation matters). KT allowed the agent to learn and perform the extended task in the simulator, which improved the average positional deviation from 0.134 m to 0.02 m, and average orientation deviation from 142{\deg} to 76{\deg} during evaluation. This KT concept shows good generalisation properties and could be applied to any actor-critic learning algorithm.

Algorithmic decision making driven by neural networks has become very prominent in applications that directly affect people's quality of life. In this paper, we study the problem of verifying, training, and guaranteeing individual fairness of neural network models. A popular approach for enforcing fairness is to translate a fairness notion into constraints over the parameters of the model. However, such a translation does not always guarantee fair predictions of the trained neural network model. To address this challenge, we develop a counterexample-guided post-processing technique to provably enforce fairness constraints at prediction time. Contrary to prior work that enforces fairness only on points around test or train data, we are able to enforce and guarantee fairness on all points in the input domain. Additionally, we propose an in-processing technique to use fairness as an inductive bias by iteratively incorporating fairness counterexamples in the learning process. We have implemented these techniques in a tool called FETA. Empirical evaluation on real-world datasets indicates that FETA is not only able to guarantee fairness on-the-fly at prediction time but also is able to train accurate models exhibiting a much higher degree of individual fairness.

The remarkable ability of language models (LMs) has also brought challenges at the interface of AI and security. A critical challenge pertains to how much information these models retain and leak about the training data. This is particularly urgent as the typical development of LMs relies on huge, often highly sensitive data, such as emails and chat logs. To contrast this shortcoming, this paper introduces Context-Aware Differentially Private Language Model (CADP-LM) , a privacy-preserving LM framework that relies on two key insights: First, it utilizes the notion of \emph{context} to define and audit the potentially sensitive information. Second, it adopts the notion of Differential Privacy to protect sensitive information and characterize the privacy leakage. A unique characteristic of CADP-LM is its ability to target the protection of sensitive sentences and contexts only, providing a highly accurate private model. Experiments on a variety of datasets and settings demonstrate these strengths of CADP-LM.

Neural networks (NNs) are known to be vulnerable against adversarial perturbations, and thus there is a line of work aiming to provide robustness certification for NNs, such as randomized smoothing, which samples smoothing noises from a certain distribution to certify the robustness for a smoothed classifier. However, as shown by previous work, the certified robust radius in randomized smoothing suffers from scaling to large datasets ("curse of dimensionality"). To overcome this hurdle, we propose a Double Sampling Randomized Smoothing (DSRS) framework, which exploits the sampled probability from an additional smoothing distribution to tighten the robustness certification of the previous smoothed classifier. Theoretically, under mild assumptions, we prove that DSRS can certify $\Theta(\sqrt d)$ robust radius under $\ell_2$ norm where $d$ is the input dimension, implying that DSRS may be able to break the curse of dimensionality of randomized smoothing. We instantiate DSRS for a generalized family of Gaussian smoothing and propose an efficient and sound computing method based on customized dual optimization considering sampling error. Extensive experiments on MNIST, CIFAR-10, and ImageNet verify our theory and show that DSRS certifies larger robust radii than existing baselines consistently under different settings. Code is available at https://github.com/llylly/DSRS.

Recently, the Successor Features and Generalized Policy Improvement (SF&GPI) framework has been proposed as a method for learning, composing, and transferring predictive knowledge and behavior. SF&GPI works by having an agent learn predictive representations (SFs) that can be combined for transfer to new tasks with GPI. However, to be effective this approach requires state features that are useful to predict, and these state-features are typically hand-designed. In this work, we present a novel neural network architecture, "Modular Successor Feature Approximators" (MSFA), where modules both discover what is useful to predict, and learn their own predictive representations. We show that MSFA is able to better generalize compared to baseline architectures for learning SFs and modular architectures

Semidefinite programs (SDPs) are convex optimization programs with vast applications in control theory, quantum information, combinatorial optimization and operational research. Noisy intermediate-scale quantum (NISQ) algorithms aim to make an efficient use of the current generation of quantum hardware. However, optimizing variational quantum algorithms is a challenge as it is an NP-hard problem that in general requires an exponential time to solve and can contain many far from optimal local minima. Here, we present a current term NISQ algorithm for solving SDPs. The classical optimization program of our NISQ solver is another SDP over a lower dimensional ansatz space. We harness the SDP based formulation of the Hamiltonian ground state problem to design a NISQ eigensolver. Unlike variational quantum eigensolvers, the classical optimization program of our eigensolver is convex, can be solved in polynomial time with the number of ansatz parameters and every local minimum is a global minimum. We find numeric evidence that NISQ SDP can improve the estimation of ground state energies in a scalable manner. Further, we efficiently solve constrained problems to calculate the excited states of Hamiltonians, find the lowest energy of symmetry constrained Hamiltonians and determine the optimal measurements for quantum state discrimination. We demonstrate the potential of our approach by finding the largest eigenvalue of up to $2^{1000}$ dimensional matrices and solving graph problems related to quantum contextuality. We also discuss NISQ algorithms for rank-constrained SDPs. Our work extends the application of NISQ computers onto one of the most successful algorithmic frameworks of the past few decades.

While many organizations have shifted to working remotely during the COVID-19 pandemic, how the remote workforce and the remote teams are influenced by and would respond to this and future shocks remain largely unknown. Software developers have relied on remote collaborations long before the pandemic, working in virtual teams (GitHub repositories). The dynamics of these repositories through the pandemic provide a unique opportunity to understand how remote teams react under shock. This work presents a systematic analysis. We measure the overall effect of the early pandemic on public GitHub repositories by comparing their sizes and productivity with the counterfactual outcomes forecasted as if there were no pandemic. We find that the productivity level and the number of active members of these teams vary significantly during different periods of the pandemic. We then conduct a finer-grained investigation and study the heterogeneous effects of the shock on individual teams. We find that the resilience of a team is highly correlated to certain properties of the team before the pandemic. Through a bootstrapped regression analysis, we reveal which types of teams are robust or fragile to the shock.

In this paper, we investigate the online allocation problem of maximizing the overall revenue subject to both lower and upper bound constraints. Compared to the extensively studied online problems with only resource upper bounds, the two-sided constraints affect the prospects of resource consumption more severely. As a result, only limited violations of constraints or pessimistic competitive bounds could be guaranteed. To tackle the challenge, we define a measure of feasibility $\xi^*$ to evaluate the hardness of this problem, and estimate this measurement by an optimization routine with theoretical guarantees. We propose an online algorithm adopting a constructive framework, where we initialize a threshold price vector using the estimation, then dynamically update the price vector and use it for decision-making at each step. It can be shown that the proposed algorithm is $\big(1-O(\frac{\varepsilon}{\xi^*-\varepsilon})\big)$ or $\big(1-O(\frac{\varepsilon}{\xi^*-\sqrt{\varepsilon}})\big)$ competitive with high probability for $\xi^*$ known or unknown respectively. To the best of our knowledge, this is the first result establishing a nearly optimal competitive algorithm for solving two-sided constrained online allocation problems with a high probability of feasibility.

Out-of-distribution (OOD) detection plays a crucial role in ensuring the safe deployment of deep neural network (DNN) classifiers. While a myriad of methods have focused on improving the performance of OOD detectors, a critical gap remains in interpreting their decisions. We help bridge this gap by providing explanations for OOD detectors based on learned high-level concepts. We first propose two new metrics for assessing the effectiveness of a particular set of concepts for explaining OOD detectors: 1) detection completeness, which quantifies the sufficiency of concepts for explaining an OOD-detector's decisions, and 2) concept separability, which captures the distributional separation between in-distribution and OOD data in the concept space. Based on these metrics, we propose a framework for learning a set of concepts that satisfy the desired properties of detection completeness and concept separability and demonstrate the framework's effectiveness in providing concept-based explanations for diverse OOD techniques. We also show how to identify prominent concepts that contribute to the detection results via a modified Shapley value-based importance score.

Federated learning (FL) has recently emerged as a distributed machine learning paradigm for systems with limited and intermittent connectivity. This paper presents the new context brought to FL by satellite constellations, where the connectivity patterns are significantly different from the ones observed in conventional terrestrial FL. The focus is on large constellations in low earth orbit (LEO), where each satellites participates in a data-driven FL task using a locally stored dataset. This scenario is motivated by the trend towards mega constellations of interconnected small satellites in LEO and the integration of artificial intelligence in satellites. We propose a classification of satellite FL based on the communication capabilities of the satellites, the constellation design, and the location of the parameter server. A comprehensive overview of the current state-of-the-art in this field is provided and the unique challenges and opportunities of satellite FL are discussed. Finally, we outline several open research directions for FL in satellite constellations and present some future perspectives on this topic.

This work presents an approach for incrementally updating deep neural network (DNN) models in a non-stationary environment. DNN models are sensitive to changes in input data distribution, which limits their application to problem settings with stationary input datasets. In a non-stationary environment, updating a DNN model requires parameter re-training or model fine-tuning. We propose an unsupervised source-free method to update DNN classification models. The contributions of this work are two-fold. First, we use trainable Gaussian prototypes to generate representative samples for future iterations; second, using unsupervised domain adaptation, we incrementally adapt the existing model using unlabelled data. Unlike existing methods, our approach can update a DNN model incrementally for non-stationary source and target tasks without storing past training data. We evaluated our work on incremental sentiment prediction and incremental disease prediction applications and compared our approach to state-of-the-art continual learning, domain adaptation, and ensemble learning methods. Our results show that our approach achieved improved performance compared to existing incremental learning methods. We observe minimal forgetting of past knowledge over many iterations, which can help us develop unsupervised self-learning systems.

Recent work on mini-batch consistency (MBC) for set functions has brought attention to the need for sequentially processing and aggregating chunks of a partitioned set while guaranteeing the same output for all partitions. However, existing constraints on MBC architectures lead to models with limited expressive power. Additionally, prior work has not addressed how to deal with large sets during training when the full set gradient is required. To address these issues, we propose a Universally MBC (UMBC) class of set functions which can be used in conjunction with arbitrary non-MBC components while still satisfying MBC, enabling a wider range of function classes to be used in MBC settings. Furthermore, we propose an efficient MBC training algorithm which gives an unbiased approximation of the full set gradient and has a constant memory overhead for any set size for both train- and test-time. We conduct extensive experiments including image completion, text classification, unsupervised clustering, and cancer detection on high-resolution images to verify the efficiency and efficacy of our scalable set encoding framework.

It has been observed that neural networks perform poorly when the data or tasks are presented sequentially. Unlike humans, neural networks suffer greatly from catastrophic forgetting, making it impossible to perform life-long learning. To address this issue, memory-based continual learning has been actively studied and stands out as one of the best-performing methods. We examine memory-based continual learning and identify that large variation in the representation space is crucial for avoiding catastrophic forgetting. Motivated by this, we propose to diversify representations by using two types of perturbations: model-agnostic variation (i.e., the variation is generated without the knowledge of the learned neural network) and model-based variation (i.e., the variation is conditioned on the learned neural network). We demonstrate that enlarging representational variation serves as a general principle to improve continual learning. Finally, we perform empirical studies which demonstrate that our method, as a simple plug-and-play component, can consistently improve a number of memory-based continual learning methods by a large margin.

Generative adversarial networks (GANs) are one powerful type of deep learning models that have been successfully utilized in numerous fields. They belong to a broader family called generative methods, which generate new data with a probabilistic model by learning sample distribution from real examples. In the clinical context, GANs have shown enhanced capabilities in capturing spatially complex, nonlinear, and potentially subtle disease effects compared to traditional generative methods. This review appraises the existing literature on the applications of GANs in imaging studies of various neurological conditions, including Alzheimer's disease, brain tumors, brain aging, and multiple sclerosis. We provide an intuitive explanation of various GAN methods for each application and further discuss the main challenges, open questions, and promising future directions of leveraging GANs in neuroimaging. We aim to bridge the gap between advanced deep learning methods and neurology research by highlighting how GANs can be leveraged to support clinical decision making and contribute to a better understanding of the structural and functional patterns of brain diseases.

In recent years, there have been significant advances in the use of deep learning methods in inverse problems such as denoising, compressive sensing, inpainting, and super-resolution. While this line of works has predominantly been driven by practical algorithms and experiments, it has also given rise to a variety of intriguing theoretical problems. In this paper, we survey some of the prominent theoretical developments in this line of works, focusing in particular on generative priors, untrained neural network priors, and unfolding algorithms. In addition to summarizing existing results in these topics, we highlight several ongoing challenges and open problems.

We present an algorithm for learning mixtures of Markov chains and Markov decision processes (MDPs) from short unlabeled trajectories. Specifically, our method handles mixtures of Markov chains with optional control input by going through a multi-step process, involving (1) a subspace estimation step, (2) spectral clustering of trajectories using "pairwise distance estimators," along with refinement using the EM algorithm, (3) a model estimation step, and (4) a classification step for predicting labels of new trajectories. We provide end-to-end performance guarantees, where we only explicitly require the length of trajectories to be linear in the number of states and the number of trajectories to be linear in a mixing time parameter. Experimental results support these guarantees, where we attain 96.6% average accuracy on a mixture of two MDPs in gridworld, outperforming the EM algorithm with random initialization (73.2% average accuracy).

Stacking (or stacked generalization) is an ensemble learning method with one main distinctiveness from the rest: even though several base models are trained on the original data set, their predictions are further used as input data for one or more metamodels arranged in at least one extra layer. Composing a stack of models can produce high-performance outcomes, but it usually involves a trial-and-error process. Therefore, our previously developed visual analytics system, StackGenVis, was mainly designed to assist users in choosing a set of top-performing and diverse models by measuring their predictive performance. However, it only employs a single logistic regression metamodel. In this paper, we investigate the impact of alternative metamodels on the performance of stacking ensembles using a novel visualization tool, called MetaStackVis. Our interactive tool helps users to visually explore different singular and pairs of metamodels according to their predictive probabilities and multiple validation metrics, as well as their ability to predict specific problematic data instances. MetaStackVis was evaluated with a usage scenario based on a medical data set and via expert interviews.

We introduce Progressive Prompts - a simple and efficient approach for continual learning in language models. Our method allows forward transfer and resists catastrophic forgetting, without relying on data replay or a large number of task-specific parameters. Progressive Prompts learns a new soft prompt for each task and sequentially concatenates it with the previously learned prompts, while keeping the base model frozen. Experiments on standard continual learning benchmarks show that our approach outperforms state-of-the-art methods, with an improvement >20% in average test accuracy over the previous best-preforming method on T5 model. We also explore a more challenging continual learning setup with longer sequences of tasks and show that Progressive Prompts significantly outperforms prior methods.

Offline reinforcement learning aims to train a policy on a pre-recorded and fixed dataset without any additional environment interactions. There are two major challenges in this setting: (1) extrapolation error caused by approximating the value of state-action pairs not well-covered by the training data and (2) distributional shift between behavior and inference policies. One way to tackle these problems is to induce conservatism - i.e., keeping the learned policies closer to the behavioral ones. To achieve this, we build upon recent works on learning policies in latent action spaces and use a special form of Normalizing Flows for constructing a generative model, which we use as a conservative action encoder. This Normalizing Flows action encoder is pre-trained in a supervised manner on the offline dataset, and then an additional policy model - controller in the latent space - is trained via reinforcement learning. This approach avoids querying actions outside of the training dataset and therefore does not require additional regularization for out-of-dataset actions. We evaluate our method on various locomotion and navigation tasks, demonstrating that our approach outperforms recently proposed algorithms with generative action models on a large portion of datasets.

Graph Semi-Supervised learning is an important data analysis tool, where given a graph and a set of labeled nodes, the aim is to infer the labels to the remaining unlabeled nodes. In this paper, we start by considering an optimization-based formulation of the problem for an undirected graph, and then we extend this formulation to multilayer hypergraphs. We solve the problem using different coordinate descent approaches and compare the results with the ones obtained by the classic gradient descent method. Experiments on synthetic and real-world datasets show the potential of using coordinate descent methods with suitable selection rules.

Deep metric learning (DML) aims to minimize empirical expected loss of the pairwise intra-/inter- class proximity violations in the embedding image. We relate DML to feasibility problem of finite chance constraints. We show that minimizer of proxy-based DML satisfies certain chance constraints, and that the worst case generalization performance of the proxy-based methods can be characterized by the radius of the smallest ball around a class proxy to cover the entire domain of the corresponding class samples, suggesting multiple proxies per class helps performance. To provide a scalable algorithm as well as exploiting more proxies, we consider the chance constraints implied by the minimizers of proxy-based DML instances and reformulate DML as finding a feasible point in intersection of such constraints, resulting in a problem to be approximately solved by iterative projections. Simply put, we repeatedly train a regularized proxy-based loss and re-initialize the proxies with the embeddings of the deliberately selected new samples. We apply our method with the well-accepted losses and evaluate on four popular benchmark datasets for image retrieval. Outperforming state-of-the-art, our method consistently improves the performance of the applied losses. Code is available at: https://github.com/yetigurbuz/ccp-dml

TemporAI is an open source Python software library for machine learning (ML) tasks involving data with a time component, focused on medicine and healthcare use cases. It supports data in time series, static, and eventmodalities and provides an interface for prediction, causal inference, and time-to-event analysis, as well as common preprocessing utilities and model interpretability methods. The library aims to facilitate innovation in the medical ML space by offering a standardized temporal setting toolkit for model development, prototyping and benchmarking, bridging the gaps in the ML research, healthcare professional, medical/pharmacological industry, and data science communities. TemporAI is available on GitHub (https://github.com/vanderschaarlab/temporai) and we welcome community engagement through use, feedback, and code contributions.

This manuscript proposes to extend the information set of time-series regression trees with latent stationary factors extracted via state-space methods. In doing so, this approach generalises time-series regression trees on two dimensions. First, it allows to handle predictors that exhibit measurement error, non-stationary trends, seasonality and/or irregularities such as missing observations. Second, it gives a transparent way for using domain-specific theory to inform time-series regression trees. As a byproduct, this technique sets the foundations for structuring powerful ensembles. Their real-world applicability is studied under the lenses of empirical macro-finance.

Hindsight goal relabeling has become a foundational technique in multi-goal reinforcement learning (RL). The essential idea is that any trajectory can be seen as a sub-optimal demonstration for reaching its final state. Intuitively, learning from those arbitrary demonstrations can be seen as a form of imitation learning (IL). However, the connection between hindsight goal relabeling and imitation learning is not well understood. In this paper, we propose a novel framework to understand hindsight goal relabeling from a divergence minimization perspective. Recasting the goal reaching problem in the IL framework not only allows us to derive several existing methods from first principles, but also provides us with the tools from IL to improve goal reaching algorithms. Experimentally, we find that under hindsight relabeling, Q-learning outperforms behavioral cloning (BC). Yet, a vanilla combination of both hurts performance. Concretely, we see that the BC loss only helps when selectively applied to actions that get the agent closer to the goal according to the Q-function. Our framework also explains the puzzling phenomenon wherein a reward of (-1, 0) results in significantly better performance than a (0, 1) reward for goal reaching.

Federated learning (FL) is a general principle for decentralized clients to train a server model collectively without sharing local data. FL is a promising framework with practical applications, but its standard training paradigm requires the clients to backpropagate through the model to compute gradients. Since these clients are typically edge devices and not fully trusted, executing backpropagation on them incurs computational and storage overhead as well as white-box vulnerability. In light of this, we develop backpropagation-free federated learning, dubbed BAFFLE, in which backpropagation is replaced by multiple forward processes to estimate gradients. BAFFLE is 1) memory-efficient and easily fits uploading bandwidth; 2) compatible with inference-only hardware optimization and model quantization or pruning; and 3) well-suited to trusted execution environments, because the clients in BAFFLE only execute forward propagation and return a set of scalars to the server. Empirically we use BAFFLE to train deep models from scratch or to finetune pretrained models, achieving acceptable results. Code is available in https://github.com/FengHZ/BAFFLE.

We construct a reduced, data-driven, parameter dependent effective Stochastic Differential Equation (eSDE) for electric-field mediated colloidal crystallization using data obtained from Brownian Dynamics Simulations. We use Diffusion Maps (a manifold learning algorithm) to identify a set of useful latent observables. In this latent space we identify an eSDE using a deep learning architecture inspired by numerical stochastic integrators and compare it with the traditional Kramers-Moyal expansion estimation. We show that the obtained variables and the learned dynamics accurately encode the physics of the Brownian Dynamic Simulations. We further illustrate that our reduced model captures the dynamics of corresponding experimental data. Our dimension reduction/reduced model identification approach can be easily ported to a broad class of particle systems dynamics experiments/models.

We propose methods for the analysis of hierarchical clustering that fully use the multi-resolution structure provided by a dendrogram. Specifically, we propose a loss for choosing between clustering methods, a feature importance score and a graphical tool for visualizing the segmentation of features in a dendrogram. Current approaches to these tasks lead to loss of information since they require the user to generate a single partition of the instances by cutting the dendrogram at a specified level. Our proposed methods, instead, use the full structure of the dendrogram. The key insight behind the proposed methods is to view a dendrogram as a phylogeny. This analogy permits the assignment of a feature value to each internal node of a tree through an evolutionary model. Real and simulated datasets provide evidence that our proposed framework has desirable outcomes and gives more insights than state-of-art approaches. We provide an R package that implements our methods.  ( 2 min )

Transformer is the cornerstone model of Natural Language Processing (NLP) over the past decade. Despite its great success in Deep Learning (DL) applications, the increasingly growing parameter space required by transformer models boosts the demand on accelerating the performance of transformer models. In addition, NLP problems can commonly be faced with variable-length sequences since their word numbers can vary among sentences. Existing DL frameworks need to pad variable-length sequences to the maximal length, which, however, leads to significant memory and computational overhead. In this paper, we present ByteTransformer, a high-performance transformer boosted for variable-length inputs. We propose a zero padding algorithm that enables the whole transformer to be free from redundant computations on useless padded tokens. Besides the algorithmic level optimization, we provide architectural-aware optimizations for transformer functioning modules, especially the performance-critical algorithm, multi-head attention (MHA). Experimental results on an NVIDIA A100 GPU with variable-length sequence inputs validate that our fused MHA (FMHA) outperforms the standard PyTorch MHA by 6.13X. The end-to-end performance of ByteTransformer for a standard BERT transformer model surpasses the state-of-the-art Transformer frameworks, such as PyTorch JIT, TensorFlow XLA, Tencent TurboTransformer and NVIDIA FasterTransformer, by 87\%, 131\%, 138\% and 46\%, respectively.  ( 2 min )

Consider an online convex optimization problem where the loss functions are self-concordant barriers, smooth relative to a convex function $h$, and possibly non-Lipschitz. We analyze the regret of online mirror descent with $h$. Then, based on the result, we prove the following in a unified manner. Denote by $T$ the time horizon and $d$ the parameter dimension. 1. For online portfolio selection, the regret of $\widetilde{\text{EG}}$, a variant of exponentiated gradient due to Helmbold et al., is $\tilde{O} ( T^{2/3} d^{1/3} )$ when $T > 4 d / \log d$. This improves on the original $\tilde{O} ( T^{3/4} d^{1/2} )$ regret bound for $\widetilde{\text{EG}}$. 2. For online portfolio selection, the regret of online mirror descent with the logarithmic barrier is $\tilde{O}(\sqrt{T d})$. The regret bound is the same as that of Soft-Bayes due to Orseau et al. up to logarithmic terms. 3. For online learning quantum states with the logarithmic loss, the regret of online mirror descent with the log-determinant function is also $\tilde{O} ( \sqrt{T d} )$. Its per-iteration time is shorter than all existing algorithms we know.  ( 2 min )

Image quality is important, and can affect overall performance in image processing and computer vision as well as for numerous other reasons. Image quality assessment (IQA) is consequently a vital task in different applications from aerial photography interpretation to object detection to medical image analysis. In previous research, the BRISQUE algorithm and the PSNR algorithm were evaluated with high resolution (atleast 512x384 pixels), but relatively small image sets (no more than 4,744 images). However, scientists have not evaluated IQA algorithms on low resolution (no more than 32x32 pixels), multi-perturbation, big image sets (for example, tleast 60,000 different images not counting their perturbations). This study explores these two IQA algorithms through experimental investigation. We first chose two deep learning image sets, CIFAR-10 and MNIST. Then, we added 68 perturbations that add noise to the images in specific sequences and noise intensities. In addition, we tracked the performance outputs of the two IQA algorithms with singly and multiply noised images. After quantitatively analyzing experimental results, we report the limitations of the two IQAs with these noised CIFAR-10 and MNIST image sets. We also explain three potential root causes for performance degradation. These findings point out weaknesses of the two IQA algorithms. The research results provide guidance to scientists and engineers developing accurate, robust IQA algorithms. All source codes, related image sets, and figures are shared on the website (https://github.com/caperock/imagequality) to support future scientific and industrial projects.  ( 2 min )

Off-policy evaluation (OPE) aims to accurately evaluate the performance of counterfactual policies using only offline logged data. Although many estimators have been developed, there is no single estimator that dominates the others, because the estimators' accuracy can vary greatly depending on a given OPE task such as the evaluation policy, number of actions, and noise level. Thus, the data-driven estimator selection problem is becoming increasingly important and can have a significant impact on the accuracy of OPE. However, identifying the most accurate estimator using only the logged data is quite challenging because the ground-truth estimation accuracy of estimators is generally unavailable. This paper studies this challenging problem of estimator selection for OPE for the first time. In particular, we enable an estimator selection that is adaptive to a given OPE task, by appropriately subsampling available logged data and constructing pseudo policies useful for the underlying estimator selection task. Comprehensive experiments on both synthetic and real-world company data demonstrate that the proposed procedure substantially improves the estimator selection compared to a non-adaptive heuristic.  ( 2 min )

We explore the problem of generating minority samples using diffusion models. The minority samples are instances that lie on low-density regions of a data manifold. Generating sufficient numbers of such minority instances is important, since they often contain some unique attributes of the data. However, the conventional generation process of the diffusion models mostly yields majority samples (that lie on high-density regions of the manifold) due to their high likelihoods, making themselves highly ineffective and time-consuming for the task. In this work, we present a novel framework that can make the generation process of the diffusion models focus on the minority samples. We first provide a new insight on the majority-focused nature of the diffusion models: they denoise in favor of the majority samples. The observation motivates us to introduce a metric that describes the uniqueness of a given sample. To address the inherent preference of the diffusion models w.r.t. the majority samples, we further develop minority guidance, a sampling technique that can guide the generation process toward regions with desired likelihood levels. Experiments on benchmark real datasets demonstrate that our minority guidance can greatly improve the capability of generating the low-likelihood minority samples over existing generative frameworks including the standard diffusion sampler.  ( 2 min )

Distributed quantum information processing protocols such as quantum entanglement distillation and quantum state discrimination rely on local operations and classical communications (LOCC). Existing LOCC-based protocols typically assume the availability of ideal, noiseless, communication channels. In this paper, we study the case in which classical communication takes place over noisy channels, and we propose to address the design of LOCC protocols in this setting via the use of quantum machine learning tools. We specifically focus on the important tasks of quantum entanglement distillation and quantum state discrimination, and implement local processing through parameterized quantum circuits (PQCs) that are optimized to maximize the average fidelity and average success probability in the respective tasks, while accounting for communication errors. The introduced approach, Noise Aware-LOCCNet (NA-LOCCNet), is shown to have significant advantages over existing protocols designed for noiseless communications.  ( 2 min )

Enumerating the directed acyclic graphs (DAGs) of a Markov equivalence class (MEC) is an important primitive in causal analysis. The central resource from the perspective of computational complexity is the delay, that is, the time an algorithm that lists all members of the class requires between two consecutive outputs. Commonly used algorithms for this task utilize the rules proposed by Meek (1995) or the transformational characterization by Chickering (1995), both resulting in superlinear delay. In this paper, we present the first linear-time delay algorithm. On the theoretical side, we show that our algorithm can be generalized to enumerate DAGs represented by models that incorporate background knowledge, such as MPDAGs; on the practical side, we provide an efficient implementation and evaluate it in a series of experiments. Complementary to the linear-time delay algorithm, we also provide intriguing insights into Markov equivalence itself: All members of an MEC can be enumerated such that two successive DAGs have structural Hamming distance at most three.  ( 2 min )

Pretrained large language models (LLMs) are widely used in many sub-fields of natural language processing (NLP) and generally known as excellent few-shot learners with task-specific exemplars. Notably, chain of thought (CoT) prompting, a recent technique for eliciting complex multi-step reasoning through step-by-step answer examples, achieved the state-of-the-art performances in arithmetics and symbolic reasoning, difficult system-2 tasks that do not follow the standard scaling laws for LLMs. While these successes are often attributed to LLMs' ability for few-shot learning, we show that LLMs are decent zero-shot reasoners by simply adding "Let's think step by step" before each answer. Experimental results demonstrate that our Zero-shot-CoT, using the same single prompt template, significantly outperforms zero-shot LLM performances on diverse benchmark reasoning tasks including arithmetics (MultiArith, GSM8K, AQUA-RAT, SVAMP), symbolic reasoning (Last Letter, Coin Flip), and other logical reasoning tasks (Date Understanding, Tracking Shuffled Objects), without any hand-crafted few-shot examples, e.g. increasing the accuracy on MultiArith from 17.7% to 78.7% and GSM8K from 10.4% to 40.7% with large InstructGPT model (text-davinci-002), as well as similar magnitudes of improvements with another off-the-shelf large model, 540B parameter PaLM. The versatility of this single prompt across very diverse reasoning tasks hints at untapped and understudied fundamental zero-shot capabilities of LLMs, suggesting high-level, multi-task broad cognitive capabilities may be extracted by simple prompting. We hope our work not only serves as the minimal strongest zero-shot baseline for the challenging reasoning benchmarks, but also highlights the importance of carefully exploring and analyzing the enormous zero-shot knowledge hidden inside LLMs before crafting finetuning datasets or few-shot exemplars.  ( 3 min )

Existing dialogue modeling methods have achieved promising performance on various dialogue tasks with the aid of Transformer and the large-scale pre-trained language models. However, some recent studies revealed that the context representations produced by these methods suffer the problem of anisotropy. In this paper, we find that the generated representations are also not conversational, losing the conversation structure information during the context modeling stage. To this end, we identify two properties in dialogue modeling, i.e., locality and isotropy, and present a simple method for dialogue representation calibration, namely SimDRC, to build isotropic and conversational feature spaces. Experimental results show that our approach significantly outperforms the current state-of-the-art models on three dialogue tasks across the automatic and human evaluation metrics. More in-depth analyses further confirm the effectiveness of our proposed approach.

No existing spherical convolutional neural network (CNN) framework is both computationally scalable and rotationally equivariant. Continuous approaches capture rotational equivariance but are often prohibitively computationally demanding. Discrete approaches offer more favorable computational performance but at the cost of equivariance. We develop a hybrid discrete-continuous (DISCO) group convolution that is simultaneously equivariant and computationally scalable to high-resolution. While our framework can be applied to any compact group, we specialize to the sphere. Our DISCO spherical convolutions exhibit $\text{SO}(3)$ rotational equivariance, where $\text{SO}(n)$ is the special orthogonal group representing rotations in $n$-dimensions. When restricting rotations of the convolution to the quotient space $\text{SO}(3)/\text{SO}(2)$ for further computational enhancements, we recover a form of asymptotic $\text{SO}(3)$ rotational equivariance. Through a sparse tensor implementation we achieve linear scaling in number of pixels on the sphere for both computational cost and memory usage. For 4k spherical images we realize a saving of $10^9$ in computational cost and $10^4$ in memory usage when compared to the most efficient alternative equivariant spherical convolution. We apply the DISCO spherical CNN framework to a number of benchmark dense-prediction problems on the sphere, such as semantic segmentation and depth estimation, on all of which we achieve the state-of-the-art performance.  ( 2 min )

Recurrent neural networks (RNNs) are widely used throughout neuroscience as models of local neural activity. Many properties of single RNNs are well characterized theoretically, but experimental neuroscience has moved in the direction of studying multiple interacting areas, and RNN theory needs to be likewise extended. We take a constructive approach towards this problem, leveraging tools from nonlinear control theory and machine learning to characterize when combinations of stable RNNs will themselves be stable. Importantly, we derive conditions which allow for massive feedback connections between interacting RNNs. We parameterize these conditions for easy optimization using gradient-based techniques, and show that stability-constrained "networks of networks" can perform well on challenging sequential-processing benchmark tasks. Altogether, our results provide a principled approach towards understanding distributed, modular function in the brain.  ( 2 min )

The paper proposes a family of communication efficient methods for distributed learning in heterogeneous environments in which users obtain data from one of $K$ different data distributions. In the proposed setup, the grouping of users based on the data distributions they sample, as well as the underlying statistical properties of the distributions are apriori unknown. A family of One-shot Distributed Clustered Learning methods (ODCL-$\mathcal{C}$) is proposed, parametrized by the set of admissible clustering algorithms $\mathcal{C}$, with the objective of learning the true model at each user. The admissible clustering methods include $K$-means (KM) and convex clustering (CC), giving rise to various one-shot methods within the proposed family, such as ODCL-KM and ODCL-CC. The proposed one-shot approach, based on local computations at the users and a clustering based aggregation step at the server is shown to provide strong learning guarantees. In particular, for strongly convex problems it is shown that, as long as the number of data points per user is above a threshold, the proposed approach achieves order-optimal mean-squared error (MSE) rates in terms of the sample size. An explicit characterization of the threshold is provided in terms of the problem parameters. Numerical experiments illustrate the findings and corroborate the performance of the proposed methods. We also highlight the trade-offs with respect to selecting various clustering methods (ODCL-CC, ODCL-KM) and demonstrate significant improvements over state-of-the-art.  ( 2 min )

Many areas of science make extensive use of computer simulators that implicitly encode likelihood functions of complex systems. Classical statistical methods are poorly suited for these so-called likelihood-free inference (LFI) settings, particularly outside asymptotic and low-dimensional regimes. Although new machine learning methods, such as normalizing flows, have revolutionized the sample efficiency and capacity of LFI methods, it remains an open question whether they produce confidence sets with correct conditional coverage for small sample sizes. This paper unifies classical statistics with modern machine learning to present (i) a practical procedure for the Neyman construction of confidence sets with finite-sample guarantees of nominal coverage, and (ii) diagnostics that estimate conditional coverage over the entire parameter space. We refer to our framework as likelihood-free frequentist inference (LF2I). Any method that defines a test statistic, like the likelihood ratio, can leverage the LF2I machinery to create valid confidence sets and diagnostics without costly Monte Carlo samples at fixed parameter settings. We study the power of two test statistics (ACORE and BFF), which, respectively, maximize versus integrate an odds function over the parameter space. Our paper discusses the benefits and challenges of LF2I, with a breakdown of the sources of errors in LF2I confidence sets.

Assortment optimization has received active explorations in the past few decades due to its practical importance. Despite the extensive literature dealing with optimization algorithms and latent score estimation, uncertainty quantification for the optimal assortment still needs to be explored and is of great practical significance. Instead of estimating and recovering the complete optimal offer set, decision makers may only be interested in testing whether a given property holds true for the optimal assortment, such as whether they should include several products of interest in the optimal set, or how many categories of products the optimal set should include. This paper proposes a novel inferential framework for testing such properties. We consider the widely adopted multinomial logit (MNL) model, where we assume that each customer will purchase an item within the offered products with a probability proportional to the underlying preference score associated with the product. We reduce inferring a general optimal assortment property to quantifying the uncertainty associated with the sign change point detection of the marginal revenue gaps. We show the asymptotic normality of the marginal revenue gap estimator, and construct a maximum statistic via the gap estimators to detect the sign change point. By approximating the distribution of the maximum statistic with multiplier bootstrap techniques, we propose a valid testing procedure. We also conduct numerical experiments to assess the performance of our method.

The manifold hypothesis, which assumes that data lies on or close to an unknown manifold of low intrinsic dimension, is a staple of modern machine learning research. However, recent work has shown that real-world data exhibits distinct non-manifold structures, i.e. singularities, that can lead to erroneous findings. Detecting such singularities is therefore crucial as a precursor to interpolation and inference tasks. We address this issue by developing a topological framework that (i) quantifies the local intrinsic dimension, and (ii) yields a Euclidicity score for assessing the 'manifoldness' of a point along multiple scales. Our approach identifies singularities of complex spaces, while also capturing singular structures and local geometric complexity in image data.  ( 2 min )

Privacy-preserving distributed distribution comparison measures the distance between the distributions whose data are scattered across different agents in a distributed system and cannot be shared among the agents. In this study, we propose a novel decentralized entropic optimal transport (EOT) method, which provides a privacy-preserving and communication-efficient solution to this problem with theoretical guarantees. In particular, we design a mini-batch randomized block-coordinate descent (MRBCD) scheme to optimize the decentralized EOT distance in its dual form. The dual variables are scattered across different agents and updated locally and iteratively with limited communications among partial agents. The kernel matrix involved in the gradients of the dual variables is estimated by a distributed kernel approximation method, and each agent only needs to approximate and store a sub-kernel matrix by one-shot communication and without sharing raw data. We analyze our method's communication complexity and provide a theoretical bound for the approximation error caused by the convergence error, the approximated kernel, and the mismatch between the storage and communication protocols. Experiments on synthetic data and real-world distributed domain adaptation tasks demonstrate the effectiveness of our method.

Traditionally, the random noise is equally injected when training with different data instances in the field of differential privacy (DP). In this paper, we first give sharper excess risk bounds of DP stochastic gradient descent (SGD) method. Considering most of the previous methods are under convex conditions, we use Polyak-{\L}ojasiewicz condition to relax it in this paper. Then, after observing that different training data instances affect the machine learning model to different extent, we consider the heterogeneity of training data and attempt to improve the performance of DP-SGD from a new perspective. Specifically, by introducing the influence function (IF), we quantitatively measure the contributions of various training data on the final machine learning model. If the contribution made by a single data instance is so little that attackers cannot infer anything from the model, we do not add noise when training with it. Based on this observation, we design a `Performance Improving' DP-SGD algorithm: PIDP-SGD. Theoretical and experimental results show that our proposed PIDP-SGD improves the performance significantly.

We investigate the expressive power of depth-2 bandlimited random neural networks. A random net is a neural network where the hidden layer parameters are frozen with random assignment, and only the output layer parameters are trained by loss minimization. Using random weights for a hidden layer is an effective method to avoid non-convex optimization in standard gradient descent learning. It has also been adopted in recent deep learning theories. Despite the well-known fact that a neural network is a universal approximator, in this study, we mathematically show that when hidden parameters are distributed in a bounded domain, the network may not achieve zero approximation error. In particular, we derive a new nontrivial approximation error lower bound. The proof utilizes the technique of ridgelet analysis, a harmonic analysis method designed for neural networks. This method is inspired by fundamental principles in classical signal processing, specifically the idea that signals with limited bandwidth may not always be able to perfectly recreate the original signal. We corroborate our theoretical results with various simulation studies, and generally, two main take-home messages are offered: (i) Not any distribution for selecting random weights is feasible to build a universal approximator; (ii) A suitable assignment of random weights exists but to some degree is associated with the complexity of the target function.

Cancer is a term that denotes a group of diseases caused by abnormal growth of cells that can spread in different parts of the body. According to the World Health Organization (WHO), cancer is the second major cause of death after cardiovascular diseases. Gene expression can play a fundamental role in the early detection of cancer, as it is indicative of the biochemical processes in tissue and cells, as well as the genetic characteristics of an organism. Deoxyribonucleic Acid (DNA) microarrays and Ribonucleic Acid (RNA)- sequencing methods for gene expression data allow quantifying the expression levels of genes and produce valuable data for computational analysis. This study reviews recent progress in gene expression analysis for cancer classification using machine learning methods. Both conventional and deep learning-based approaches are reviewed, with an emphasis on the ap-plication of deep learning models due to their comparative advantages for identifying gene patterns that are distinctive for various types of cancers. Relevant works that employ the most commonly used deep neural network architectures are covered, including multi-layer perceptrons, convolutional, recurrent, graph, and transformer networks. This survey also presents an overview of the data collection methods for gene expression analysis and lists important datasets that are commonly used for supervised machine learning for this task. Furthermore, reviewed are pertinent techniques for feature engineering and data preprocessing that are typically used to handle the high dimensionality of gene expression data, caused by a large number of genes present in data samples. The paper concludes with a discussion of future research directions for machine learning-based gene expression analysis for cancer classification.

Domain generalization (DG) seeks predictors which perform well on unseen test distributions by leveraging data drawn from multiple related training distributions or domains. To achieve this, DG is commonly formulated as an average- or worst-case problem over the set of possible domains. However, predictors that perform well on average lack robustness while predictors that perform well in the worst case tend to be overly-conservative. To address this, we propose a new probabilistic framework for DG where the goal is to learn predictors that perform well with high probability. Our key idea is that distribution shifts seen during training should inform us of probable shifts at test time, which we realize by explicitly relating training and test domains as draws from the same underlying meta-distribution. To achieve probable DG, we propose a new optimization problem called Quantile Risk Minimization (QRM). By minimizing the $\alpha$-quantile of predictor's risk distribution over domains, QRM seeks predictors that perform well with probability $\alpha$. To solve QRM in practice, we propose the Empirical QRM (EQRM) algorithm and provide: (i) a generalization bound for EQRM; and (ii) the conditions under which EQRM recovers the causal predictor as $\alpha \to 1$. In our experiments, we introduce a more holistic quantile-focused evaluation protocol for DG and demonstrate that EQRM outperforms state-of-the-art baselines on datasets from WILDS and DomainBed.  ( 2 min )

Tuning all the hyperparameters of differentially private (DP) machine learning (ML) algorithms often requires use of sensitive data and this may leak private information via hyperparameter values. Recently, Papernot and Steinke (2022) proposed a certain class of DP hyperparameter tuning algorithms, where the number of random search samples is randomized itself. Commonly, these algorithms still considerably increase the DP privacy parameter $\varepsilon$ over non-tuned DP ML model training and can be computationally heavy as evaluating each hyperparameter candidate requires a new training run. We focus on lowering both the DP bounds and the computational complexity of these methods by using only a random subset of the sensitive data for the hyperparameter tuning and by extrapolating the optimal values from the small dataset to a larger dataset. We provide a R\'enyi differential privacy analysis for the proposed method and experimentally show that it consistently leads to better privacy-utility trade-off than the baseline method by Papernot and Steinke (2022).

In this paper, we study kernelized bandits with distributed biased feedback. This problem is motivated by several real-world applications (such as dynamic pricing, cellular network configuration, and policy making), where users from a large population contribute to the reward of the action chosen by a central entity, but it is difficult to collect feedback from all users. Instead, only biased feedback (due to user heterogeneity) from a subset of users may be available. In addition to such partial biased feedback, we are also faced with two practical challenges due to communication cost and computation complexity. To tackle these challenges, we carefully design a new \emph{distributed phase-then-batch-based elimination (\texttt{DPBE})} algorithm, which samples users in phases for collecting feedback to reduce the bias and employs \emph{maximum variance reduction} to select actions in batches within each phase. By properly choosing the phase length, the batch size, and the confidence width used for eliminating suboptimal actions, we show that \texttt{DPBE} achieves a sublinear regret of $\tilde{O}(T^{1-\alpha/2}+\sqrt{\gamma_T T})$, where $\alpha\in (0,1)$ is the user-sampling parameter one can tune. Moreover, \texttt{DPBE} can significantly reduce both communication cost and computation complexity in distributed kernelized bandits, compared to some variants of the state-of-the-art algorithms (originally developed for standard kernelized bandits). Furthermore, by incorporating various \emph{differential privacy} models (including the central, local, and shuffle models), we generalize \texttt{DPBE} to provide privacy guarantees for users participating in the distributed learning process. Finally, we conduct extensive simulations to validate our theoretical results and evaluate the empirical performance.

Offline safe RL is of great practical relevance for deploying agents in real-world applications. However, acquiring constraint-satisfying policies from the fixed dataset is non-trivial for conventional approaches. Even worse, the learned constraints are stationary and may become invalid when the online safety requirement changes. In this paper, we present a novel offline safe RL approach referred to as SaFormer, which tackles the above issues via conditional sequence modeling. In contrast to existing sequence models, we propose cost-related tokens to restrict the action space and a posterior safety verification to enforce the constraint explicitly. Specifically, SaFormer performs a two-stage auto-regression conditioned by the maximum remaining cost to generate feasible candidates. It then filters out unsafe attempts and executes the optimal action with the highest expected return. Extensive experiments demonstrate the efficacy of SaFormer featuring (1) competitive returns with tightened constraint satisfaction; (2) adaptability to the in-range cost values of the offline data without retraining; (3) generalizability for constraints beyond the current dataset.  ( 2 min )

Recent works on neural network pruning advocate that reducing the depth of the network is more effective in reducing run-time memory usage and accelerating inference latency than reducing the width of the network through channel pruning. In this regard, some recent works propose depth compression algorithms that merge convolution layers. However, the existing algorithms have a constricted search space and rely on human-engineered heuristics. In this paper, we propose a novel depth compression algorithm which targets general convolution operations. We propose a subset selection problem that replaces inefficient activation layers with identity functions and optimally merges consecutive convolution operations into shallow equivalent convolution operations for efficient end-to-end inference latency. Since the proposed subset selection problem is NP-hard, we formulate a surrogate optimization problem that can be solved exactly via two-stage dynamic programming within a few seconds. We evaluate our methods and baselines by TensorRT for a fair inference latency comparison. Our method outperforms the baseline method with higher accuracy and faster inference speed in MobileNetV2 on the ImageNet dataset. Specifically, we achieve $1.61\times$speed-up with only $0.62$\%p accuracy drop in MobileNetV2-1.4 on the ImageNet.

The advancement of distributed generation technologies in modern power systems has led to a widespread integration of renewable power generation at customer side. However, the intermittent nature of renewable energy poses new challenges to the network operational planning with underlying uncertainties. This paper proposes a novel Bayesian probabilistic technique for forecasting renewable solar generation by addressing data and model uncertainties by integrating bidirectional long short-term memory (BiLSTM) neural networks while compressing the weight parameters using variational autoencoder (VAE). Existing Bayesian deep learning methods suffer from high computational complexities as they require to draw a large number of samples from weight parameters expressed in the form of probability distributions. The proposed method can deal with uncertainty present in model and data in a more computationally efficient manner by reducing the dimensionality of model parameters. The proposed method is evaluated using quantile loss, reconstruction error, and deterministic forecasting evaluation metrics such as root-mean square error. It is inferred from the numerical results that VAE-Bayesian BiLSTM outperforms other probabilistic and deterministic deep learning methods for solar power forecasting in terms of accuracy and computational efficiency for different sizes of the dataset.

We present a subset selection algorithm designed to work with arbitrary model families in a practical batch setting. In such a setting, an algorithm can sample examples one at a time but, in order to limit overhead costs, is only able to update its state (i.e. further train model weights) once a large enough batch of examples is selected. Our algorithm, IWeS, selects examples by importance sampling where the sampling probability assigned to each example is based on the entropy of models trained on previously selected batches. IWeS admits significant performance improvement compared to other subset selection algorithms for seven publicly available datasets. Additionally, it is competitive in an active learning setting, where the label information is not available at selection time. We also provide an initial theoretical analysis to support our importance weighting approach, proving generalization and sampling rate bounds.

Neuro-symbolic methods integrate neural architectures, knowledge representation and reasoning. However, they have been struggling at both dealing with the intrinsic uncertainty of the observations and scaling to real-world applications. This paper presents Relational Reasoning Networks (R2N), a novel end-to-end model that performs relational reasoning in the latent space of a deep learner architecture, where the representations of constants, ground atoms and their manipulations are learned in an integrated fashion. Unlike flat architectures like Knowledge Graph Embedders, which can only represent relations between entities, R2Ns define an additional computational structure, accounting for higher-level relations among the ground atoms. The considered relations can be explicitly known, like the ones defined by logic formulas, or defined as unconstrained correlations among groups of ground atoms. R2Ns can be applied to purely symbolic tasks or as a neuro-symbolic platform to integrate learning and reasoning in heterogeneous problems with both symbolic and feature-based represented entities. The proposed model overtakes the limitations of previous neuro-symbolic methods that have been either limited in terms of scalability or expressivity. The proposed methodology is shown to achieve state-of-the-art results in different experimental settings.

Due to the inability to interact with the environment, offline reinforcement learning (RL) methods face the challenge of estimating the Out-of-Distribution (OOD) points. Most existing methods exclude the OOD areas or restrict the value of $Q$ function. However, these methods either are over-conservative or suffer from model uncertainty prediction. In this paper, we propose an authorized probabilistic-control policy learning (APAC) method. The proposed method learns the distribution characteristics of the feasible states/actions by utilizing the flow-GAN model. Specifically, APAC avoids taking action in the low probability density region of behavior policy, while allows exploration in the authorized high probability density region. Theoretical proofs are provided to justify the advantage of APAC. Empirically, APAC outperforms existing alternatives on a variety of simulated tasks, and yields higher expected returns.

Today, artificial neural networks are the state of the art for solving a variety of complex tasks, especially in image classification. Such architectures consist of a sequence of stacked layers with the aim of extracting useful information and having it processed by a classifier to make accurate predictions. However, intermediate information within such models is often left unused. In other cases, such as in edge computing contexts, these architectures are divided into multiple partitions that are made functional by including early exits, i.e. intermediate classifiers, with the goal of reducing the computational and temporal load without extremely compromising the accuracy of the classifications. In this paper, we present Anticipate, Ensemble and Prune (AEP), a new training technique based on weighted ensembles of early exits, which aims at exploiting the information in the structure of networks to maximise their performance. Through a comprehensive set of experiments, we show how the use of this approach can yield average accuracy improvements of up to 15% over traditional training. In its hybrid-weighted configuration, AEP's internal pruning operation also allows reducing the number of parameters by up to 41%, lowering the number of multiplications and additions by 18% and the latency time to make inference by 16%. By using AEP, it is also possible to learn weights that allow early exits to achieve better accuracy values than those obtained from single-output reference models.

Spiking neural network (SNN) operating with asynchronous discrete events shows higher energy efficiency. A popular approach to implementing deep SNNs is ANN-SNN conversion combining both efficient training of ANNs and efficient inference of SNNs. However, due to the intrinsic difference between ANNs and SNNs, the accuracy loss is usually non-negligible, especially under low simulating steps. It restricts the applications of SNN on latency-sensitive edge devices greatly. In this paper, we identify such performance degradation stems from the misrepresentation of the negative or overflow residual membrane potential in SNNs. Inspired by this, we systematically analyze the conversion error between SNNs and ANNs, and then decompose it into three folds: quantization error, clipping error, and residual membrane potential representation error. With such insights, we propose a dual-phase conversion algorithm to minimize those errors separately. Besides, we show each phase achieves significant performance gains in a complementary manner. We evaluate our method on challenging datasets including CIFAR-10, CIFAR-100, and ImageNet datasets. The experimental results show the proposed method achieves the state-of-the-art in terms of both accuracy and latency with promising energy preservation compared to ANNs. For instance, our method achieves an accuracy of 73.20% on CIFAR-100 in only 2 time steps with 15.7$\times$ less energy consumption.

Source separation entails the ill-posed problem of retrieving a set of source signals observed through a mixing operator. Solving this problem requires prior knowledge, which is commonly incorporated by imposing regularity conditions on the source signals or implicitly learned in supervised or unsupervised methods from existing data. While data-driven methods have shown great promise in source separation, they are often dependent on large amounts of data, which rarely exists in planetary space missions. Considering this challenge, we propose an unsupervised source separation scheme for domains with limited data access that involves solving an optimization problem in the wavelet scattering representation space$\unicode{x2014}$an interpretable low-dimensional representation of stationary processes. We present a real-data example in which we remove transient thermally induced microtilts, known as glitches, from data recorded by a seismometer during NASA's InSight mission on Mars. Owing to the wavelet scattering covariances' ability to capture non-Gaussian properties of stochastic processes, we are able to separate glitches using only a few glitch-free data snippets.

Geo-tagged photo based tourist attraction recommendation can discover users' travel preferences from their taken photos, so as to recommend suitable tourist attractions to them. However, existing visual content based methods cannot fully exploit the user and tourist attraction information of photos to extract visual features, and do not differentiate the significances of different photos. In this paper, we propose multi-level visual similarity based personalized tourist attraction recommendation using geo-tagged photos (MEAL). MEAL utilizes the visual contents of photos and interaction behavior data to obtain the final embeddings of users and tourist attractions, which are then used to predict the visit probabilities. Specifically, by crossing the user and tourist attraction information of photos, we define four visual similarity levels and introduce a corresponding quintuplet loss to embed the visual contents of photos. In addition, to capture the significances of different photos, we exploit the self-attention mechanism to obtain the visual representations of users and tourist attractions. We conducted experiments on a dataset crawled from Flickr, and the experimental results proved the advantage of this method.

Real-world systems are made of interacting entities that evolve with time. Creating models that can forecast interactions by learning the dynamics of entities is an important problem in numerous fields. Earlier works used dynamic graph models to achieve this. However, real-world interactions are more complex than pairwise, as they involve more than two entities, and many of these higher-order interactions have directional components. Examples of these can be seen in communication networks such as email exchanges that involve a sender, and multiple recipients, citation networks, where authors draw upon the work of others, and so on. In this paper, we solve the problem of higher-order directed interaction forecasting by proposing a deep neural network-based model \textit{Directed HyperNode Temporal Point Process} for directed hyperedge event forecasting, as hyperedge provides native framework for modeling relationships among the variable number of nodes. Our proposed technique reduces the search space of possible candidate hyperedges by first forecasting the nodes at which events will be observed, based on which it generates candidate hyperedges. To demonstrate the efficiency of our model, we curated four datasets and conducted an extensive empirical study. We believe that this is the first work that solves the problem of forecasting higher-order directional interactions.

Prompting approaches have been recently explored in text style transfer, where a textual prompt is used to query a pretrained language model to generate style-transferred texts word by word in an autoregressive manner. However, such a generation process is less controllable and early prediction errors may affect future word predictions. In this paper, we present a prompt-based editing approach for text style transfer. Specifically, we prompt a pretrained language model for style classification and use the classification probability to compute a style score. Then, we perform discrete search with word-level editing to maximize a comprehensive scoring function for the style-transfer task. In this way, we transform a prompt-based generation problem into a classification one, which is a training-free process and more controllable than the autoregressive generation of sentences. In our experiments, we performed both automatic and human evaluation on three style-transfer benchmark datasets, and show that our approach largely outperforms the state-of-the-art systems that have 20 times more parameters. Additional empirical analyses further demonstrate the effectiveness of our approach.

Large pretrained language models have been widely used in downstream NLP tasks via task-specific fine-tuning. Recently, an array of Parameter-Efficient Fine-Tuning (PEFT) methods have also achieved strong task performance while updating a much smaller number of parameters compared to full model tuning. However, it is non-trivial to make informed per-task design choices (i.e., to create PEFT configurations) concerning the selection of PEFT architectures and modules, the number of tunable parameters, and even the layers in which the PEFT modules are inserted. Consequently, it is highly likely that the current, manually set PEFT configurations might be suboptimal for many tasks from the perspective of the performance-to-efficiency trade-off. To address the core question of the PEFT configuration selection that aims to control and maximise the balance between performance and parameter efficiency, we first define a rich configuration search space spanning multiple representative PEFT modules along with finer-grained configuration decisions over the modules (e.g., parameter budget, insertion layer). We then propose AutoPEFT, a novel framework to traverse this configuration space: it automatically configures multiple PEFT modules via high-dimensional Bayesian optimisation. We show the resource scalability and task transferability of AutoPEFT-found configurations, outperforming existing PEFT methods on average on the standard GLUE benchmark while conducting the configuration search on a single task. The per-task AutoPEFT-based configuration search even outperforms full-model fine-tuning.

Directed Exploration is a crucial challenge in reinforcement learning (RL), especially when rewards are sparse. Information-directed sampling (IDS), which optimizes the information ratio, seeks to do so by augmenting regret with information gain. However, estimating information gain is computationally intractable or relies on restrictive assumptions which prohibit its use in many practical instances. In this work, we posit an alternative exploration incentive in terms of the integral probability metric (IPM) between a current estimate of the transition model and the unknown optimal, which under suitable conditions, can be computed in closed form with the kernelized Stein discrepancy (KSD). Based on KSD, we develop a novel algorithm STEERING: \textbf{STE}in information dir\textbf{E}cted exploration for model-based \textbf{R}einforcement Learn\textbf{ING}. To enable its derivation, we develop fundamentally new variants of KSD for discrete conditional distributions. We further establish that STEERING archives sublinear Bayesian regret, improving upon prior learning rates of information-augmented MBRL, IDS included. Experimentally, we show that the proposed algorithm is computationally affordable and outperforms several prior approaches.

Neural networks achieved high performance over different tasks, i.e. image identification, voice recognition and other applications. Despite their success, these models are still vulnerable regarding small perturbations, which can be used to craft the so-called adversarial examples. Different approaches have been proposed to circumvent their vulnerability, including formal verification systems, which employ a variety of techniques, including reachability, optimization and search procedures, to verify that the model satisfies some property. In this paper we propose three novel reachability algorithms for verifying deep neural networks with ReLU activations. The first and third algorithms compute an over-approximation for the reachable set, whereas the second one computes the exact reachable set. Differently from previously proposed approaches, our algorithms take as input a V-polytope. Our experiments on the ACAS Xu problem show that the Exact Polytope Network Mapping (EPNM) reachability algorithm proposed in this work surpass the state-of-the-art results from the literature, specially in relation to other reachability methods.

This work presents an incremental learning approach for autonomous agents to learn new tasks in a non-stationary environment. Updating a DNN model-based agent to learn new target tasks requires us to store past training data and needs a large labeled target task dataset. Few-shot task incremental learning methods overcome the limitation of labeled target datasets by adapting trained models to learn private target classes using a few labeled representatives and a large unlabeled target dataset. However, the methods assume that the source and target tasks are stationary. We propose a one-shot task incremental learning approach that can adapt to non-stationary source and target tasks. Our approach minimizes adversarial discrepancy between the model's feature space and incoming incremental data to learn an updated hypothesis. We also use distillation loss to reduce catastrophic forgetting of previously learned tasks. Finally, we use Gaussian prototypes to generate exemplar instances eliminating the need to store past training data. Unlike current work in task incremental learning, our model can learn both source and target task updates incrementally. We evaluate our method on various problem settings for incremental object detection and disease prediction model update. We evaluate our approach by measuring the performance of shared class and target private class prediction. Our results show that our approach achieved improved performance compared to existing state-of-the-art task incremental learning methods.

Decades of practices of ramp metering, by controlling downstream volume and smoothing the interweaving traffic, have proved that ramp metering can decrease total travel time, mitigate shockwaves, decrease rear-end collisions, reduce pollution, etc. Besides traditional methods like ALIENA algorithms, Deep Reinforcement Learning algorithms have been established recently to build finer control on ramp metering. However, those Deep Learning models may be venerable to adversarial attacks. Thus, it is important to investigate the robustness of those models under False Data Injection adversarial attack. Furthermore, algorithms capable of detecting anomaly data from clean data are the key to safeguard Deep Learning algorithm. In this study, an online algorithm that can distinguish adversarial data from clean data are tested. Results found that in most cases anomaly data can be distinguished from clean data, although their difference is too small to be manually distinguished by humans. In practice, whenever adversarial/hazardous data is detected, the system can fall back to a fixed control program, and experts should investigate the detectors status or security protocols afterwards before real damages happen.

Most of today's communication systems are designed to target reliable message recovery after receiving the entire encoded message (codeword). However, in many practical scenarios, the transmission process may be interrupted before receiving the complete codeword. This paper proposes a novel rateless autoencoder (AE)-based code design suitable for decoding the transmitted message before the noisy codeword is fully received. Using particular dropout strategies applied during the training process, rateless AE codes allow to trade off between decoding delay and reliability, providing a graceful improvement of the latter with each additionally received codeword symbol. The proposed rateless AEs significantly outperform the conventional AE designs for scenarios where it is desirable to trade off reliability for lower decoding delay.

Text-to-image diffusion models have recently received a lot of interest for their astonishing ability to produce high-fidelity images from text only. However, achieving one-shot generation that aligns with the user's intent is nearly impossible, yet small changes to the input prompt often result in very different images. This leaves the user with little semantic control. To put the user in control, we show how to interact with the diffusion process to flexibly steer it along semantic directions. This semantic guidance (SEGA) allows for subtle and extensive edits, changes in composition and style, as well as optimizing the overall artistic conception. We demonstrate SEGA's effectiveness on a variety of tasks and provide evidence for its versatility and flexibility.  ( 2 min )

We study the problem of performance optimization of closed-loop control systems with unmodeled dynamics. Bayesian optimization (BO) has been demonstrated to be effective for improving closed-loop performance by automatically tuning controller gains or reference setpoints in a model-free manner. However, BO methods have rarely been tested on dynamical systems with unmodeled constraints and time-varying ambient conditions. In this paper, we propose a violation-aware contextual BO algorithm (VACBO) that optimizes closed-loop performance while simultaneously learning constraint-feasible solutions under time-varying ambient conditions. Unlike classical constrained BO methods which allow unlimited constraint violations, or 'safe' BO algorithms that are conservative and try to operate with near-zero violations, we allow budgeted constraint violations to improve constraint learning and accelerate optimization. We demonstrate the effectiveness of our proposed VACBO method for energy minimization of industrial vapor compression systems under time-varying ambient temperature and humidity.

Neural network controllers (NNCs) have shown great promise in autonomous and cyber-physical systems. Despite the various verification approaches for neural networks, the safety analysis of NNCs remains an open problem. Existing verification approaches for neural network control systems (NNCSs) either can only work on a limited type of activation functions, or result in non-trivial over-approximation errors with time evolving. This paper proposes a verification framework for NNCS based on Lipschitzian optimisation, called DeepNNC. We first prove the Lipschitz continuity of closed-loop NNCSs by unrolling and eliminating the loops. We then reveal the working principles of applying Lipschitzian optimisation on NNCS verification and illustrate it by verifying an adaptive cruise control model. Compared to state-of-the-art verification approaches, DeepNNC shows superior performance in terms of efficiency and accuracy over a wide range of NNCs. We also provide a case study to demonstrate the capability of DeepNNC to handle a real-world, practical, and complex system. Our tool \textbf{DeepNNC} is available at \url{https://github.com/TrustAI/DeepNNC}.

The striking fractal geometry of strange attractors underscores the generative nature of chaos: like probability distributions, chaotic systems can be repeatedly measured to produce arbitrarily-detailed information about the underlying attractor. Chaotic systems thus pose a unique challenge to modern statistical learning techniques, while retaining quantifiable mathematical properties that make them controllable and interpretable as benchmarks. Here, we present a growing database currently comprising 131 known chaotic dynamical systems spanning fields such as astrophysics, climatology, and biochemistry. Each system is paired with precomputed multivariate and univariate time series. Our dataset has comparable scale to existing static time series databases; however, our systems can be re-integrated to produce additional datasets of arbitrary length and granularity. Our dataset is annotated with known mathematical properties of each system, and we perform feature analysis to broadly categorize the diverse dynamics present across the collection. Chaotic systems inherently challenge forecasting models, and across extensive benchmarks we correlate forecasting performance with the degree of chaos present. We also exploit the unique generative properties of our dataset in several proof-of-concept experiments: surrogate transfer learning to improve time series classification, importance sampling to accelerate model training, and benchmarking symbolic regression algorithms.

There are many recent research efforts to fine-tune a pre-trained generator with a few target images to generate images of a novel domain. Unfortunately, these methods often suffer from overfitting or under-fitting when fine-tuned with a single target image. To address this, here we present a novel single-shot GAN adaptation method through unified CLIP space manipulations. Specifically, our model employs a two-step training strategy: reference image search in the source generator using a CLIP-guided latent optimization, followed by generator fine-tuning with a novel loss function that imposes CLIP space consistency between the source and adapted generators. To further improve the adapted model to produce spatially consistent samples with respect to the source generator, we also propose contrastive regularization for patchwise relationships in the CLIP space. Experimental results show that our model generates diverse outputs with the target texture and outperforms the baseline models both qualitatively and quantitatively. Furthermore, we show that our CLIP space manipulation strategy allows more effective attribute editing.  ( 2 min )

Graph Neural Networks (GNNs) are powerful in learning rich network representations that aid the performance of downstream tasks. However, recent studies showed that GNNs are vulnerable to adversarial attacks involving node injection and network perturbation. Among these, node injection attacks are more practical as they don't require manipulation in the existing network and can be performed more realistically. In this paper, we propose a novel problem statement - a class-specific poison attack on graphs in which the attacker aims to misclassify specific nodes in the target class into a different class using node injection. Additionally, nodes are injected in such a way that they camouflage as benign nodes. We propose NICKI, a novel attacking strategy that utilizes an optimization-based approach to sabotage the performance of GNN-based node classifiers. NICKI works in two phases - it first learns the node representation and then generates the features and edges of the injected nodes. Extensive experiments and ablation studies on four benchmark networks show that NICKI is consistently better than four baseline attacking strategies for misclassifying nodes in the target class. We also show that the injected nodes are properly camouflaged as benign, thus making the poisoned graph indistinguishable from its clean version w.r.t various topological properties.

We study nonlinear optimization problems with a stochastic objective and deterministic equality and inequality constraints, which emerge in numerous applications including finance, manufacturing, power systems and, recently, deep neural networks. We propose an active-set stochastic sequential quadratic programming (StoSQP) algorithm that utilizes a differentiable exact augmented Lagrangian as the merit function. The algorithm adaptively selects the penalty parameters of the augmented Lagrangian and performs a stochastic line search to decide the stepsize. The global convergence is established: for any initialization, the KKT residuals converge to zero almost surely. Our algorithm and analysis further develop the prior work of Na et al., (2022). Specifically, we allow nonlinear inequality constraints without requiring the strict complementary condition; refine some of the designs in Na et al., (2022) such as the feasibility error condition and the monotonically increasing sample size; strengthen the global convergence guarantee; and improve the sample complexity on the objective Hessian. We demonstrate the performance of the designed algorithm on a subset of nonlinear problems collected in CUTEst test set and on constrained logistic regression problems.

With model trustworthiness being crucial for sensitive real-world applications, practitioners are putting more and more focus on improving the uncertainty calibration of deep neural networks. Calibration errors are designed to quantify the reliability of probabilistic predictions but their estimators are usually biased and inconsistent. In this work, we introduce the framework of proper calibration errors, which relates every calibration error to a proper score and provides a respective upper bound with optimal estimation properties. This relationship can be used to reliably quantify the model calibration improvement. We theoretically and empirically demonstrate the shortcomings of commonly used estimators compared to our approach. Due to the wide applicability of proper scores, this gives a natural extension of recalibration beyond classification.

Personalized medicine, a paradigm of medicine tailored to a patient's characteristics, is an increasingly attractive field in health care. An important goal of personalized medicine is to identify a subgroup of patients, based on baseline covariates, that benefits more from the targeted treatment than other comparative treatments. Most of the current subgroup identification methods only focus on obtaining a subgroup with an enhanced treatment effect without paying attention to subgroup size. Yet, a clinically meaningful subgroup learning approach should identify the maximum number of patients who can benefit from the better treatment. In this paper, we present an optimal subgroup selection rule (SSR) that maximizes the number of selected patients, and in the meantime, achieves the pre-specified clinically meaningful mean outcome, such as the average treatment effect. We derive two equivalent theoretical forms of the optimal SSR based on the contrast function that describes the treatment-covariates interaction in the outcome. We further propose a ConstrAined PolIcy Tree seArch aLgorithm (CAPITAL) to find the optimal SSR within the interpretable decision tree class. The proposed method is flexible to handle multiple constraints that penalize the inclusion of patients with negative treatment effects, and to address time to event data using the restricted mean survival time as the clinically interesting mean outcome. Extensive simulations, comparison studies, and real data applications are conducted to demonstrate the validity and utility of our method.

Few-shot classification consists of a training phase where a model is learned on a relatively large dataset and an adaptation phase where the learned model is adapted to previously-unseen tasks with limited labeled samples. In this paper, we empirically prove that the training algorithm and the adaptation algorithm can be completely disentangled, which allows algorithm analysis and design to be done individually for each phase. Our meta-analysis for each phase reveals several interesting insights that may help better understand key aspects of few-shot classification and connections with other fields such as visual representation learning and transfer learning. We hope the insights and research challenges revealed in this paper can inspire future work in related directions.

Predictive algorithms, such as deep neural networks (DNNs), are used in many domain sciences to directly estimate internal parameters of interest in simulator-based models, especially in settings where the observations include images or other complex high-dimensional data. In parallel, modern neural density estimators, such as normalizing flows, are becoming increasingly popular for uncertainty quantification, especially when both parameters and observations are high-dimensional. However, parameter inference is an inverse problem and not a prediction task; thus, an open challenge is to construct conditionally valid and precise confidence regions, with a guaranteed probability of covering the true parameters of the data-generating process, no matter what the (unknown) parameter values are, and without relying on large-sample theory. Many simulator-based inference (SBI) methods are indeed known to produce biased or overly confident parameter regions, yielding misleading uncertainty estimates. This paper presents WALDO, a novel method for constructing confidence regions with finite-sample conditional validity by leveraging prediction algorithms or posterior estimators that are currently widely adopted in SBI. WALDO reframes the well-known Wald test statistic, and uses a computationally efficient regression-based machinery for classical Neyman inversion of hypothesis tests. We apply our method to a recent high-energy physics problem, where prediction with DNNs has previously led to estimates with prediction bias. We also illustrate how our approach can correct overly confident posterior regions computed with normalizing flows.

Knowledge distillation (KD) is one of the prominent techniques for model compression. In this method, the knowledge of a large network (teacher) is distilled into a model (student) with usually significantly fewer parameters. KD tries to better-match the output of the student model to that of the teacher model based on the knowledge extracts from the forward pass of the teacher network. Although conventional KD is effective for matching the two networks over the given data points, there is no guarantee that these models would match in other areas for which we do not have enough training samples. In this work, we address that problem by generating new auxiliary training samples based on extracting knowledge from the backward pass of the teacher in the areas where the student diverges greatly from the teacher. We compute the difference between the teacher and the student and generate new data samples that maximize the divergence. This is done by perturbing data samples in the direction of the gradient of the difference between the student and the teacher. Augmenting the training set by adding this auxiliary improves the performance of KD significantly and leads to a closer match between the student and the teacher. Using this approach, when data samples come from a discrete domain, such as applications of natural language processing (NLP) and language understanding, is not trivial. However, we show how this technique can be used successfully in such applications. We evaluated the performance of our method on various tasks in computer vision and NLP domains and got promising results.

So-called implicit behavioral cloning with energy-based models has shown promising results in robotic manipulation tasks. We tested if the method's advantages carry on to controlling the steering of a real self-driving car with an end-to-end driving model. We performed an extensive comparison of the implicit behavioral cloning approach with explicit baseline approaches, all sharing the same neural network backbone architecture. Baseline explicit models were trained with regression (MAE) loss, classification loss (softmax and cross-entropy on a discretization), or as mixture density networks (MDN). While models using the energy-based formulation performed comparably to baseline approaches in terms of safety driver interventions, they had a higher whiteness measure, indicating higher jerk. To alleviate this, we show two methods that can be used to improve the smoothness of steering. We confirmed that energy-based models handle multimodalities slightly better than simple regression, but this did not translate to significantly better driving ability. We argue that the steering-only road-following task has too few multimodalities to benefit from energy-based models. This shows that applying implicit behavioral cloning to real-world tasks can be challenging, and further investigation is needed to bring out the theoretical advantages of energy-based models.

Incorporating a deep generative model as the prior distribution in inverse problems has established substantial success in reconstructing images from corrupted observations. Notwithstanding, the existing optimization approaches use gradient descent largely without adapting to the non-convex nature of the problem and can be sensitive to initial values, impeding further performance improvement. In this paper, we propose an efficient amortized optimization scheme for inverse problems with a deep generative prior. Specifically, the optimization task with high degrees of difficulty is decomposed into optimizing a sequence of much easier ones. We provide a theoretical guarantee of the proposed algorithm and empirically validate it on different inverse problems. As a result, our approach outperforms baseline methods qualitatively and quantitatively by a large margin.

We propose policy gradient algorithms which learn risk-sensitive policies in a reinforcement learning (RL) framework. Our proposed algorithms maximize the distortion risk measure (DRM) of the cumulative reward in an episodic Markov decision process in on-policy as well as off-policy RL settings. We derive a variant of the policy gradient theorem that caters to the DRM objective, and use this theorem in conjunction with a likelihood ratio-based gradient estimation scheme. We derive non-asymptotic bounds that establish the convergence of our proposed algorithms to an approximate stationary point of the DRM objective.  ( 2 min )

This paper outlines an end-to-end optimized lossy image compression framework using diffusion generative models. The approach relies on the transform coding paradigm, where an image is mapped into a latent space for entropy coding and, from there, mapped back to the data space for reconstruction. In contrast to VAE-based neural compression, where the (mean) decoder is a deterministic neural network, our decoder is a conditional diffusion model. Our approach thus introduces an additional ``content'' latent variable on which the reverse diffusion process is conditioned and uses this variable to store information about the image. The remaining ``texture'' latent variables characterizing the diffusion process are synthesized (stochastically or deterministically) at decoding time. We show that the model's performance can be tuned toward perceptual metrics of interest. Our extensive experiments involving five datasets and sixteen image quality assessment metrics show that our approach yields the strongest reported FID scores while also yielding competitive performance with state-of-the-art models in several SIM-based reference metrics.  ( 2 min )

While there are many score-based models with various diffusing strategies as well as many numerical schemes of the denoising process, only a few works have explored the score part of the generative SDE. This paper introduces a new generative SDE with score adjustment using an auxiliary discriminator. The goal is to improve the original generative process of a pre-trained diffusion model by estimating the gap between the pre-trained score estimation and the true data score. This is done by training a discriminator that classifies diffused real data and diffused sample data. The gap estimation is then used to adjust the pre-trained score network. In experiments, the method enables new SOTA FIDs of 1.77/1.64 on unconditional/conditional CIFAR-10, and new SOTA FID/sFID of 3.18/4.53 on ImageNet 256x256.  ( 2 min )

We study a novel setting in Online Markov Decision Processes (OMDPs) where the loss function is chosen by a non-oblivious strategic adversary who follows a no-external regret algorithm. In this setting, we first demonstrate that MDP-Expert, an existing algorithm that works well with oblivious adversaries can still apply and achieve a policy regret bound of $\mathcal{O}(\sqrt{T \log(L)}+\tau^2\sqrt{ T \log(|A|)})$ where $L$ is the size of adversary's pure strategy set and $|A|$ denotes the size of agent's action space. Considering real-world games where the support size of a NE is small, we further propose a new algorithm: MDP-Online Oracle Expert (MDP-OOE), that achieves a policy regret bound of $\mathcal{O}(\sqrt{T\log(L)}+\tau^2\sqrt{ T k \log(k)})$ where $k$ depends only on the support size of the NE. MDP-OOE leverages the key benefit of Double Oracle in game theory and thus can solve games with prohibitively large action space. Finally, to better understand the learning dynamics of no-regret methods, under the same setting of no-external regret adversary in OMDPs, we introduce an algorithm that achieves last-round convergence result to a NE. To our best knowledge, this is first work leading to the last iteration result in OMDPs.  ( 2 min )

Quantum machine learning (QML) offers a powerful, flexible paradigm for programming near-term quantum computers, with applications in chemistry, metrology, materials science, data science, and mathematics. Here, one trains an ansatz, in the form of a parameterized quantum circuit, to accomplish a task of interest. However, challenges have recently emerged suggesting that deep ansatzes are difficult to train, due to flat training landscapes caused by randomness or by hardware noise. This motivates our work, where we present a variable structure approach to build ansatzes for QML. Our approach, called VAns (Variable Ansatz), applies a set of rules to both grow and (crucially) remove quantum gates in an informed manner during the optimization. Consequently, VAns is ideally suited to mitigate trainability and noise-related issues by keeping the ansatz shallow. We employ VAns in the variational quantum eigensolver for condensed matter and quantum chemistry applications, in the quantum autoencoder for data compression and in unitary compilation problems showing successful results in all cases.  ( 2 min )

Choosing a good resource configuration for big data analytics applications can be challenging, especially in cloud environments. Automated approaches are desirable as poor decisions can reduce performance and raise costs. The majority of existing automated approaches either build performance models from previous workload executions or conduct iterative resource configuration profiling until a near-optimal solution has been found. In doing so, they only obtain an implicit understanding of the underlying infrastructure, which is difficult to transfer to alternative infrastructures and, thus, profiling and modeling insights are not sustained beyond very specific situations. We present Perona, a novel approach to robust infrastructure fingerprinting for usage in the context of big data analytics. Perona employs common sets and configurations of benchmarking tools for target resources, so that resulting benchmark metrics are directly comparable and ranking is enabled. Insignificant benchmark metrics are discarded by learning a low-dimensional representation of the input metric vector, and previous benchmark executions are taken into consideration for context-awareness as well, allowing to detect resource degradation. We evaluate our approach both on data gathered from our own experiments as well as within related works for resource configuration optimization, demonstrating that Perona captures the characteristics from benchmark runs in a compact manner and produces representations that can be used directly.  ( 2 min )

Personalized decision-making can be implemented in a Federated learning (FL) framework that can collaboratively train a decision model by extracting knowledge across intelligent clients, e.g. smartphones or enterprises. FL can mitigate the data privacy risk of collaborative training since it merely collects local gradients from users without access to their data. However, FL is fragile in the presence of statistical heterogeneity that is commonly encountered in personalized decision-making, e.g., non-IID data over different clients. Existing FL approaches usually update a single global model to capture the shared knowledge of all users by aggregating their gradients, regardless of the discrepancy between their data distributions. By comparison, a mixture of multiple global models could capture the heterogeneity across various clients if assigning the client to different global models (i.e., centers) in FL. To this end, we propose a novel multi-center aggregation mechanism to cluster clients using their models' parameters. It learns multiple global models from data as the cluster centers, and simultaneously derives the optimal matching between users and centers. We then formulate it as an optimization problem that can be efficiently solved by a stochastic expectation maximization (EM) algorithm. Experiments on multiple benchmark datasets of FL show that our method outperforms several popular baseline methods. The experimental source codes are publicly available on the Github repository https://github.com/mingxuts/multi-center-fed-learning .  ( 2 min )

Integral equations (IEs) are equations that model spatiotemporal systems with non-local interactions. They have found important applications throughout theoretical and applied sciences, including in physics, chemistry, biology, and engineering. While efficient algorithms exist for solving given IEs, no method exists that can learn an IE and its associated dynamics from data alone. In this paper, we introduce Neural Integral Equations (NIE), a method that learns an unknown integral operator from data through an IE solver. We also introduce Attentional Neural Integral Equations (ANIE), where the integral is replaced by self-attention, which improves scalability and model capacity. We demonstrate that (A)NIE outperforms other methods in both speed and accuracy on several benchmark tasks in ODE, PDE, and IE systems of synthetic and real-world data.  ( 2 min )

Federated Learning (FL) has gained increasing interest in recent years as a distributed on-device learning paradigm. However, multiple challenges remain to be addressed for deploying FL in real-world Internet-of-Things (IoT) networks with hierarchies. Although existing works have proposed various approaches to account data heterogeneity, system heterogeneity, unexpected stragglers and scalibility, none of them provides a systematic solution to address all of the challenges in a hierarchical and unreliable IoT network. In this paper, we propose an asynchronous and hierarchical framework (Async-HFL) for performing FL in a common three-tier IoT network architecture. In response to the largely varied delays, Async-HFL employs asynchronous aggregations at both the gateway and the cloud levels thus avoids long waiting time. To fully unleash the potential of Async-HFL in converging speed under system heterogeneities and stragglers, we design device selection at the gateway level and device-gateway association at the cloud level. Device selection chooses edge devices to trigger local training in real-time while device-gateway association determines the network topology periodically after several cloud epochs, both satisfying bandwidth limitation. We evaluate Async-HFL's convergence speedup using large-scale simulations based on ns-3 and a network topology from NYCMesh. Our results show that Async-HFL converges 1.08-1.31x faster in wall-clock time and saves up to 21.6% total communication cost compared to state-of-the-art asynchronous FL algorithms (with client selection). We further validate Async-HFL on a physical deployment and observe robust convergence under unexpected stragglers.  ( 2 min )

Domain-specific machine learning (ML) accelerators such as Google's TPU and Apple's Neural Engine now dominate CPUs and GPUs for energy-efficient ML processing. However, the evolution of electronic accelerators is facing fundamental limits due to the limited computation density of monolithic processing chips and the reliance on slow metallic interconnects. In this paper, we present a vision of how optical computation and communication can be integrated into 2.5D chiplet platforms to drive an entirely new class of sustainable and scalable ML hardware accelerators. We describe how cross-layer design and fabrication of optical devices, circuits, and architectures, and hardware/software codesign can help design efficient photonics-based 2.5D chiplet platforms to accelerate emerging ML workloads.  ( 2 min )

Self-supervised sequential recommendation significantly improves recommendation performance by maximizing mutual information with well-designed data augmentations. However, the mutual information estimation is based on the calculation of Kullback Leibler divergence with several limitations, including asymmetrical estimation, the exponential need of the sample size, and training instability. Also, existing data augmentations are mostly stochastic and can potentially break sequential correlations with random modifications. These two issues motivate us to investigate an alternative robust mutual information measurement capable of modeling uncertainty and alleviating KL divergence limitations. To this end, we propose a novel self-supervised learning framework based on Mutual WasserStein discrepancy minimization MStein for the sequential recommendation. We propose the Wasserstein Discrepancy Measurement to measure the mutual information between augmented sequences. Wasserstein Discrepancy Measurement builds upon the 2-Wasserstein distance, which is more robust, more efficient in small batch sizes, and able to model the uncertainty of stochastic augmentation processes. We also propose a novel contrastive learning loss based on Wasserstein Discrepancy Measurement. Extensive experiments on four benchmark datasets demonstrate the effectiveness of MStein over baselines. More quantitative analyses show the robustness against perturbations and training efficiency in batch size. Finally, improvements analysis indicates better representations of popular users or items with significant uncertainty. The source code is at https://github.com/zfan20/MStein.  ( 2 min )

In this paper, we propose several new stochastic second-order algorithms for policy optimization that only require gradient and Hessian-vector product in each iteration, making them computationally efficient and comparable to policy gradient methods. Specifically, we propose a dimension-reduced second-order method (DR-SOPO) which repeatedly solves a projected two-dimensional trust region subproblem. We show that DR-SOPO obtains an $\mathcal{O}(\epsilon^{-3.5})$ complexity for reaching approximate first-order stationary condition and certain subspace second-order stationary condition. In addition, we present an enhanced algorithm (DVR-SOPO) which further improves the complexity to $\mathcal{O}(\epsilon^{-3})$ based on the variance reduction technique. Preliminary experiments show that our proposed algorithms perform favorably compared with stochastic and variance-reduced policy gradient methods.  ( 2 min )

Answering complex queries on incomplete knowledge graphs is a challenging task where a model needs to answer complex logical queries in the presence of missing knowledge. Recently, Arakelyan et al. (2021); Minervini et al. (2022) showed that neural link predictors could also be used for answering complex queries: their Continuous Query Decomposition (CQD) method works by decomposing complex queries into atomic sub-queries, answers them using neural link predictors and aggregates their scores via t-norms for ranking the answers to each complex query. However, CQD does not handle negations and only uses the training signal from atomic training queries: neural link prediction scores are not calibrated to interact together via fuzzy logic t-norms during complex query answering. In this work, we propose to address this problem by training a parameter-efficient score adaptation model to re-calibrate neural link prediction scores: this new component is trained on complex queries by back-propagating through the complex query-answering process. Our method, CQD$^{A}$, produces significantly more accurate results than current state-of-the-art methods, improving from $34.4$ to $35.1$ Mean Reciprocal Rank values averaged across all datasets and query types while using $\leq 35\%$ of the available training query types. We further show that CQD$^{A}$ is data-efficient, achieving competitive results with only $1\%$ of the training data, and robust in out-of-domain evaluations.

Stochastic linear contextual bandit algorithms have substantial applications in practice, such as recommender systems, online advertising, clinical trials, etc. Recent works show that optimal bandit algorithms are vulnerable to adversarial attacks and can fail completely in the presence of attacks. Existing robust bandit algorithms only work for the non-contextual setting under the attack of rewards and cannot improve the robustness in the general and popular contextual bandit environment. In addition, none of the existing methods can defend against attacked context. In this work, we provide the first robust bandit algorithm for stochastic linear contextual bandit setting under a fully adaptive and omniscient attack with sub-linear regret. Our algorithm not only works under the attack of rewards, but also under attacked context. Moreover, it does not need any information about the attack budget or the particular form of the attack. We provide theoretical guarantees for our proposed algorithm and show by experiments that our proposed algorithm improves the robustness against various kinds of popular attacks.

Contrastive Learning (CL) has been proved to be a powerful self-supervised approach for a wide range of domains, including computer vision and graph representation learning. However, the incremental learning issue of CL has rarely been studied, which brings the limitation in applying it to real-world applications. Contrastive learning identifies the samples with the negative ones from the noise distribution that changes in the incremental scenarios. Therefore, only fitting the change of data without noise distribution causes bias, and directly retraining results in low efficiency. To bridge this research gap, we propose a self-supervised Incremental Contrastive Learning (ICL) framework consisting of (i) a novel Incremental InfoNCE (NCE-II) loss function by estimating the change of noise distribution for old data to guarantee no bias with respect to the retraining, (ii) a meta-optimization with deep reinforced Learning Rate Learning (LRL) mechanism which can adaptively learn the learning rate according to the status of the training processes and achieve fast convergence which is critical for incremental learning. Theoretically, the proposed ICL is equivalent to retraining, which is based on solid mathematical derivation. In practice, extensive experiments in different domains demonstrate that, without retraining a new model, ICL achieves up to 16.7x training speedup and 16.8x faster convergence with competitive results.  ( 2 min )

Large neural models (such as Transformers) achieve state-of-the-art performance for information retrieval (IR). In this paper, we aim to improve distillation methods that pave the way for the deployment of such models in practice. The proposed distillation approach supports both retrieval and re-ranking stages and crucially leverages the relative geometry among queries and documents learned by the large teacher model. It goes beyond existing distillation methods in the IR literature, which simply rely on the teacher's scalar scores over the training data, on two fronts: providing stronger signals about local geometry via embedding matching and attaining better coverage of data manifold globally via query generation. Embedding matching provides a stronger signal to align the representations of the teacher and student models. At the same time, query generation explores the data manifold to reduce the discrepancies between the student and teacher where training data is sparse. Our distillation approach is theoretically justified and applies to both dual encoder (DE) and cross-encoder (CE) models. Furthermore, for distilling a CE model to a DE model via embedding matching, we propose a novel dual pooling-based scorer for the CE model that facilitates a distillation-friendly embedding geometry, especially for DE student models.  ( 2 min )

Deep neural networks (DNNs) have seen tremendous success in many fields and their developments in PDE-related problems are rapidly growing. This paper provides an estimate for the generalization error of learning Lipschitz operators over Banach spaces using DNNs with applications to various PDE solution operators. The goal is to specify DNN width, depth, and the number of training samples needed to guarantee a certain testing error. Under mild assumptions on data distributions or operator structures, our analysis shows that deep operator learning can have a relaxed dependence on the discretization resolution of PDEs and, hence, lessen the curse of dimensionality in many PDE-related problems. We apply our results to various PDEs, including elliptic equations, parabolic equations, and Burgers equations.

We propose a novel parameterized skill-learning algorithm that aims to learn transferable parameterized skills and synthesize them into a new action space that supports efficient learning in long-horizon tasks. We propose to leverage off-policy Meta-RL combined with a trajectory-centric smoothness term to learn a set of parameterized skills. Our agent can use these learned skills to construct a three-level hierarchical framework that models a Temporally-extended Parameterized Action Markov Decision Process. We empirically demonstrate that the proposed algorithms enable an agent to solve a set of difficult long-horizon (obstacle-course and robot manipulation) tasks.  ( 2 min )

Gradient-based meta-learning methods have primarily been applied to classical machine learning tasks such as image classification. Recently, PDE-solving deep learning methods, such as neural operators, are starting to make an important impact on learning and predicting the response of a complex physical system directly from observational data. Since the data acquisition in this context is commonly challenging and costly, the call of utilization and transfer of existing knowledge to new and unseen physical systems is even more acute. Herein, we propose a novel meta-learning approach for neural operators, which can be seen as transferring the knowledge of solution operators between governing (unknown) PDEs with varying parameter fields. Our approach is a provably universal solution operator for multiple PDE solving tasks, with a key theoretical observation that underlying parameter fields can be captured in the first layer of neural operator models, in contrast to typical final-layer transfer in existing meta-learning methods. As applications, we demonstrate the efficacy of our proposed approach on PDE-based datasets and a real-world material modeling problem, illustrating that our method can handle complex and nonlinear physical response learning tasks while greatly improving the sampling efficiency in unseen tasks.  ( 2 min )

Bayesian Neural Networks (BNNs) provide a tool to estimate the uncertainty of a neural network by considering a distribution over weights and sampling different models for each input. In this paper, we propose a method for uncertainty estimation in neural networks which, instead of considering a distribution over weights, samples outputs of each layer from a corresponding Gaussian distribution, parametrized by the predictions of mean and variance sub-layers. In uncertainty quality estimation experiments, we show that the proposed method achieves better uncertainty quality than other single-bin Bayesian Model Averaging methods, such as Monte Carlo Dropout or Bayes By Backpropagation methods.  ( 2 min )

Regulation, legal liabilities, and societal concerns challenge the adoption of AI in safety and security-critical applications. One of the key concerns is that adversaries can cause harm by manipulating model predictions without being detected. Regulation hence demands an assessment of the risk of damage caused by adversaries. Yet, there is no method to translate this high-level demand into actionable metrics that quantify the risk of damage. In this article, we propose a method to model and statistically estimate the probability of damage arising from adversarial attacks. We show that our proposed estimator is statistically consistent and unbiased. In experiments, we demonstrate that the estimation results of our method have a clear and actionable interpretation and outperform conventional metrics. We then show how operators can use the estimation results to reliably select the model with the lowest risk.  ( 2 min )

We address end-to-end learned video compression with a special focus on better learning and utilizing temporal contexts. For temporal context mining, we propose to store not only the previously reconstructed frames, but also the propagated features into the generalized decoded picture buffer. From the stored propagated features, we propose to learn multi-scale temporal contexts, and re-fill the learned temporal contexts into the modules of our compression scheme, including the contextual encoder-decoder, the frame generator, and the temporal context encoder. Our scheme discards the parallelization-unfriendly auto-regressive entropy model to pursue a more practical decoding time. We compare our scheme with x264 and x265 (representing industrial software for H.264 and H.265, respectively) as well as the official reference software for H.264, H.265, and H.266 (JM, HM, and VTM, respectively). When intra period is 32 and oriented to PSNR, our scheme outperforms H.265--HM by 14.4% bit rate saving; when oriented to MS-SSIM, our scheme outperforms H.266--VTM by 21.1% bit rate saving.  ( 2 min )

We study the task of prompting large-scale language models to perform multi-step reasoning. Existing work shows that when prompted with a chain of thoughts (CoT), sequences of short sentences describing intermediate reasoning steps towards a final answer, large language models can generate new reasoning chains and predict answers for new inputs. A central question is which reasoning examples make the most effective prompts. In this work, we propose complexity-based prompting, a simple and effective example selection scheme for multi-step reasoning. We show that prompts with higher reasoning complexity, i.e., chains with more reasoning steps, achieve substantially better performance on multi-step reasoning tasks over strong baselines. We further extend our complexity-based criteria from prompting (selecting inputs) to decoding (selecting outputs), where we sample multiple reasoning chains from the model, then choose the majority of generated answers from complex reasoning chains (over simple chains). When used to prompt GPT-3 and Codex, our approach substantially improves multi-step reasoning accuracy and achieves new state-of-the-art (SOTA) performance on three math benchmarks (GSM8K, MultiArith, and MathQA) and two BigBenchHard tasks (Date Understanding and Penguins), with an average +5.3 and up to +18 accuracy improvements. Compared with existing example selection schemes like manual tuning or retrieval-based selection, selection based on reasoning complexity is intuitive, easy to implement, and annotation-efficient. Further results demonstrate the robustness of performance gains from complex prompts under format perturbation and distribution shift.  ( 2 min )

Graphs are a powerful data structure to represent relational data and are widely used to describe complex real-world data structures. Probabilistic Graphical Models (PGMs) have been well-developed in the past years to mathematically model real-world scenarios in compact graphical representations of distributions of variables. Graph Neural Networks (GNNs) are new inference methods developed in recent years and are attracting growing attention due to their effectiveness and flexibility in solving inference and learning problems over graph-structured data. These two powerful approaches have different advantages in capturing relations from observations and how they conduct message passing, and they can benefit each other in various tasks. In this survey, we broadly study the intersection of GNNs and PGMs. Specifically, we first discuss how GNNs can benefit from learning structured representations in PGMs, generate explainable predictions by PGMs, and how PGMs can infer object relationships. Then we discuss how GNNs are implemented in PGMs for more efficient inference and structure learning. In the end, we summarize the benchmark datasets used in recent studies and discuss promising future directions.  ( 2 min )

Evaluating the performance of an ongoing policy plays a vital role in many areas such as medicine and economics, to provide crucial instruction on the early-stop of the online experiment and timely feedback from the environment. Policy evaluation in online learning thus attracts increasing attention by inferring the mean outcome of the optimal policy (i.e., the value) in real-time. Yet, such a problem is particularly challenging due to the dependent data generated in the online environment, the unknown optimal policy, and the complex exploration and exploitation trade-off in the adaptive experiment. In this paper, we aim to overcome these difficulties in policy evaluation for online learning. We explicitly derive the probability of exploration that quantifies the probability of exploring the non-optimal actions under commonly used bandit algorithms. We use this probability to conduct valid inference on the online conditional mean estimator under each action and develop the doubly robust interval estimation (DREAM) method to infer the value under the estimated optimal policy in online learning. The proposed value estimator provides double protection on the consistency and is asymptotically normal with a Wald-type confidence interval provided. Extensive simulations and real data applications are conducted to demonstrate the empirical validity of the proposed DREAM method.  ( 2 min )

We propose a graph clustering formulation based on multicut (a.k.a. weighted correlation clustering) on the complete graph. Our formulation does not need specification of the graph topology as in the original sparse formulation of multicut, making our approach simpler and potentially better performing. In contrast to unweighted correlation clustering we allow for a more expressive weighted cost structure. In dense multicut, the clustering objective is given in a factorized form as inner products of node feature vectors. This allows for an efficient formulation and inference in contrast to multicut/weighted correlation clustering, which has at least quadratic representation and computation complexity when working on the complete graph. We show how to rewrite classical greedy algorithms for multicut in our dense setting and how to modify them for greater efficiency and solution quality. In particular, our algorithms scale to graphs with tens of thousands of nodes. Empirical evidence on instance segmentation on Cityscapes and clustering of ImageNet datasets shows the merits of our approach.  ( 2 min )

Detecting anomalies is one fundamental aspect of a safety-critical software system, however, it remains a long-standing problem. Numerous branches of works have been proposed to alleviate the complication and have demonstrated their efficiencies. In particular, self-supervised learning based methods are spurring interest due to their capability of learning diverse representations without additional labels. Among self-supervised learning tactics, contrastive learning is one specific framework validating their superiority in various fields, including anomaly detection. However, the primary objective of contrastive learning is to learn task-agnostic features without any labels, which is not entirely suited to discern anomalies. In this paper, we propose a task-specific variant of contrastive learning named masked contrastive learning, which is more befitted for anomaly detection. Moreover, we propose a new inference method dubbed self-ensemble inference that further boosts performance by leveraging the ability learned through auxiliary self-supervision tasks. By combining our models, we can outperform previous state-of-the-art methods by a significant margin on various benchmark datasets.  ( 2 min )

Learning effective protein representations is critical in a variety of tasks in biology such as predicting protein function or structure. Existing approaches usually pretrain protein language models on a large number of unlabeled amino acid sequences and then finetune the models with some labeled data in downstream tasks. Despite the effectiveness of sequence-based approaches, the power of pretraining on known protein structures, which are available in smaller numbers only, has not been explored for protein property prediction, though protein structures are known to be determinants of protein function. In this paper, we propose to pretrain protein representations according to their 3D structures. We first present a simple yet effective encoder to learn the geometric features of a protein. We pretrain the protein graph encoder by leveraging multiview contrastive learning and different self-prediction tasks. Experimental results on both function prediction and fold classification tasks show that our proposed pretraining methods outperform or are on par with the state-of-the-art sequence-based methods, while using much less pretraining data. Our implementation is available at https://github.com/DeepGraphLearning/GearNet.  ( 2 min )

Since random initial models in Federated Learning (FL) can easily result in unregulated Stochastic Gradient Descent (SGD) processes, existing FL methods greatly suffer from both slow convergence and poor accuracy, especially for non-IID scenarios. To address this problem, we propose a novel FL method named CyclicFL, which can quickly derive effective initial models to guide the SGD processes, thus improving the overall FL training performance. Based on the concept of Continual Learning (CL), we prove that CyclicFL approximates existing centralized pre-training methods in terms of classification and prediction performance. Meanwhile, we formally analyze the significance of data consistency between the pre-training and training stages of CyclicFL, showing the limited Lipschitzness of loss for the pre-trained models by CyclicFL. Unlike traditional centralized pre-training methods that require public proxy data, CyclicFL pre-trains initial models on selected clients cyclically without exposing their local data. Therefore, they can be easily integrated into any security-critical FL methods. Comprehensive experimental results show that CyclicFL can not only improve the classification accuracy by up to 16.21%, but also significantly accelerate the overall FL training processes.  ( 2 min )

In this paper, we investigate the Rademacher complexity of deep sparse neural networks, where each neuron receives a small number of inputs. We prove generalization bounds for multilayered sparse ReLU neural networks, including convolutional neural networks. These bounds differ from previous ones, as they consider the norms of the convolutional filters instead of the norms of the associated Toeplitz matrices, independently of weight sharing between neurons. As we show theoretically, these bounds may be orders of magnitude better than standard norm-based generalization bounds and empirically, they are almost non-vacuous in estimating generalization in various simple classification problems. Taken together, these results suggest that compositional sparsity of the underlying target function is critical to the success of deep neural networks.  ( 2 min )

Reinforcement learning, mathematically described by Markov Decision Problems, may be approached either through dynamic programming or policy search. Actor-critic algorithms combine the merits of both approaches by alternating between steps to estimate the value function and policy gradient updates. Due to the fact that the updates exhibit correlated noise and biased gradient updates, only the asymptotic behavior of actor-critic is known by connecting its behavior to dynamical systems. This work puts forth a new variant of actor-critic that employs Monte Carlo rollouts during the policy search updates, which results in controllable bias that depends on the number of critic evaluations. As a result, we are able to provide for the first time the convergence rate of actor-critic algorithms when the policy search step employs policy gradient, agnostic to the choice of policy evaluation technique. In particular, we establish conditions under which the sample complexity is comparable to stochastic gradient method for non-convex problems or slower as a result of the critic estimation error, which is the main complexity bottleneck. These results hold in continuous state and action spaces with linear function approximation for the value function. We then specialize these conceptual results to the case where the critic is estimated by Temporal Difference, Gradient Temporal Difference, and Accelerated Gradient Temporal Difference. These learning rates are then corroborated on a navigation problem involving an obstacle and the pendulum problem which provide insight into the interplay between optimization and generalization in reinforcement learning.  ( 2 min )

The widespread deployment of deep nets in practical applications has lead to a growing desire to understand how and why such black-box methods perform prediction. Much work has focused on understanding what part of the input pattern (an image, say) is responsible for a particular class being predicted, and how the input may be manipulated to predict a different class. We focus instead on understanding which of the internal features computed by the neural net are responsible for a particular class. We achieve this by mimicking part of the neural net with an oblique decision tree having sparse weight vectors at the decision nodes. Using the recently proposed Tree Alternating Optimization (TAO) algorithm, we are able to learn trees that are both highly accurate and interpretable. Such trees can faithfully mimic the part of the neural net they replaced, and hence they can provide insights into the deep net black box. Further, we show we can easily manipulate the neural net features in order to make the net predict, or not predict, a given class, thus showing that it is possible to carry out adversarial attacks at the level of the features. These insights and manipulations apply globally to the entire training and test set, not just at a local (single-instance) level. We demonstrate this robustly in the MNIST and ImageNet datasets with LeNet5 and VGG networks.  ( 2 min )

We consider off-policy evaluation of dynamic treatment rules under sequential ignorability, given an assumption that the underlying system can be modeled as a partially observed Markov decision process (POMDP). We propose an estimator, partial history importance weighting, and show that it can consistently estimate the stationary mean rewards of a target policy given long enough draws from the behavior policy. We provide an upper bound on its error that decays polynomially in the number of observations (i.e., the number of trajectories times their length), with an exponent that depends on the overlap of the target and behavior policies, and on the mixing time of the underlying system. Furthermore, we show that this rate of convergence is minimax given only our assumptions on mixing and overlap. Our results establish that off-policy evaluation in POMDPs is strictly harder than off-policy evaluation in (fully observed) Markov decision processes, but strictly easier than model-free off-policy evaluation.  ( 2 min )

We introduce a causal framework for designing optimal policies that satisfy fairness constraints. We take a pragmatic approach asking what we can do with an action space available to us and only with access to historical data. We propose two different fairness constraints: a moderation breaking constraint which aims at blocking moderation paths from the action and sensitive attribute to the outcome, and by that at reducing disparity in outcome levels as much as the provided action space permits; and an equal benefit constraint which aims at distributing gain from the new and maximized policy equally across sensitive attribute levels, and thus at keeping pre-existing preferential treatment in place or avoiding the introduction of new disparity. We introduce practical methods for implementing the constraints and illustrate their uses on experiments with semi-synthetic models.  ( 2 min )

Survival analysis studies time-modeling techniques for an event of interest occurring for a population. Survival analysis found widespread applications in healthcare, engineering, and social sciences. However, the data needed to train survival models are often distributed, incomplete, censored, and confidential. In this context, federated learning can be exploited to tremendously improve the quality of the models trained on distributed data while preserving user privacy. However, federated survival analysis is still in its early development, and there is no common benchmarking dataset to test federated survival models. This work proposes a novel technique for constructing realistic heterogeneous datasets by starting from existing non-federated datasets in a reproducible way. Specifically, we provide two novel dataset-splitting algorithms based on the Dirichlet distribution to assign each data sample to a carefully chosen client: quantity-skewed splitting and label-skewed splitting. Furthermore, these algorithms allow for obtaining different levels of heterogeneity by changing a single hyperparameter. Finally, numerical experiments provide a quantitative evaluation of the heterogeneity level using log-rank tests and a qualitative analysis of the generated splits. The implementation of the proposed methods is publicly available in favor of reproducibility and to encourage common practices to simulate federated environments for survival analysis.  ( 2 min )

This paper builds bridges between two families of probabilistic algorithms: (hierarchical) variational inference (VI), which is typically used to model distributions over continuous spaces, and generative flow networks (GFlowNets), which have been used for distributions over discrete structures such as graphs. We demonstrate that, in certain cases, VI algorithms are equivalent to special cases of GFlowNets in the sense of equality of expected gradients of their learning objectives. We then point out the differences between the two families and show how these differences emerge experimentally. Notably, GFlowNets, which borrow ideas from reinforcement learning, are more amenable than VI to off-policy training without the cost of high gradient variance induced by importance sampling. We argue that this property of GFlowNets can provide advantages for capturing diversity in multimodal target distributions.  ( 2 min )

As a regression technique in spatial statistics, the spatiotemporally varying coefficient model (STVC) is an important tool for discovering nonstationary and interpretable response-covariate associations over both space and time. However, it is difficult to apply STVC for large-scale spatiotemporal analyses due to its high computational cost. To address this challenge, we summarize the spatiotemporally varying coefficients using a third-order tensor structure and propose to reformulate the spatiotemporally varying coefficient model as a special low-rank tensor regression problem. The low-rank decomposition can effectively model the global patterns of the large data sets with a substantially reduced number of parameters. To further incorporate the local spatiotemporal dependencies, we use Gaussian process (GP) priors on the spatial and temporal factor matrices. We refer to the overall framework as Bayesian Kernelized Tensor Regression (BKTR). For model inference, we develop an efficient Markov chain Monte Carlo (MCMC) algorithm, which uses Gibbs sampling to update factor matrices and slice sampling to update kernel hyperparameters. We conduct extensive experiments on both synthetic and real-world data sets, and our results confirm the superior performance and efficiency of BKTR for model estimation and parameter inference.  ( 2 min )

Network intrusion detection systems (NIDSs) play an important role in computer network security. There are several detection mechanisms where anomaly-based automated detection outperforms others significantly. Amid the sophistication and growing number of attacks, dealing with large amounts of data is a recognized issue in the development of anomaly-based NIDS. However, do current models meet the needs of today's networks in terms of required accuracy and dependability? In this research, we propose a new hybrid model that combines machine learning and deep learning to increase detection rates while securing dependability. Our proposed method ensures efficient pre-processing by combining SMOTE for data balancing and XGBoost for feature selection. We compared our developed method to various machine learning and deep learning algorithms to find a more efficient algorithm to implement in the pipeline. Furthermore, we chose the most effective model for network intrusion based on a set of benchmarked performance analysis criteria. Our method produces excellent results when tested on two datasets, KDDCUP'99 and CIC-MalMem-2022, with an accuracy of 99.99% and 100% for KDDCUP'99 and CIC-MalMem-2022, respectively, and no overfitting or Type-1 and Type-2 issues.  ( 2 min )

An individualized decision rule (IDR) is a decision function that assigns each individual a given treatment based on his/her observed characteristics. Most of the existing works in the literature consider settings with binary or finitely many treatment options. In this paper, we focus on the continuous treatment setting and propose a jump interval-learning to develop an individualized interval-valued decision rule (I2DR) that maximizes the expected outcome. Unlike IDRs that recommend a single treatment, the proposed I2DR yields an interval of treatment options for each individual, making it more flexible to implement in practice. To derive an optimal I2DR, our jump interval-learning method estimates the conditional mean of the outcome given the treatment and the covariates via jump penalized regression, and derives the corresponding optimal I2DR based on the estimated outcome regression function. The regressor is allowed to be either linear for clear interpretation or deep neural network to model complex treatment-covariates interactions. To implement jump interval-learning, we develop a searching algorithm based on dynamic programming that efficiently computes the outcome regression function. Statistical properties of the resulting I2DR are established when the outcome regression function is either a piecewise or continuous function over the treatment space. We further develop a procedure to infer the mean outcome under the (estimated) optimal policy. Extensive simulations and a real data application to a warfarin study are conducted to demonstrate the empirical validity of the proposed I2DR.  ( 2 min )

Improving the deployment efficiency of transformer-based language models has been challenging given their high computation and memory cost. While INT8 quantization has recently been shown to be effective in reducing both the memory cost and latency while preserving model accuracy, it remains unclear whether we can leverage INT4 (which doubles peak hardware throughput) to achieve further latency improvement. In this work, we fully investigate the feasibility of using INT4 quantization for language models, and show that using INT4 introduces no or negligible accuracy degradation for encoder-only and encoder-decoder models, but causes a significant accuracy drop for decoder-only models. To materialize the performance gain using INT4, we develop a highly-optimized end-to-end INT4 encoder inference pipeline supporting different quantization strategies. Our INT4 pipeline is $8.5\times$ faster for latency-oriented scenarios and up to $3\times$ for throughput-oriented scenarios compared to the inference of FP16, and improves the SOTA BERT INT8 performance from FasterTransformer by up to $1.7\times$. We also provide insights into the failure cases when applying INT4 to decoder-only models, and further explore the compatibility of INT4 quantization with other compression techniques, like pruning and layer reduction.  ( 2 min )

Existing bounds on the generalization error of deep networks assume some form of smooth or bounded dependence on the input variable, falling short of investigating the mechanisms controlling such factors in practice. In this work, we present an extensive experimental study of the empirical Lipschitz constant of deep networks undergoing double descent, and highlight non-monotonic trends strongly correlating with the test error. Building a connection between parameter-space and input-space gradients for SGD around a critical point, we isolate two important factors -- namely loss landscape curvature and distance of parameters from initialization -- respectively controlling optimization dynamics around a critical point and bounding model function complexity, even beyond the training data. Our study presents novels insights on implicit regularization via overparameterization, and effective model complexity for networks trained in practice.  ( 2 min )

Research on continual learning (CL) mainly focuses on data represented in the Euclidean space, while research on graph-structured data is scarce. Furthermore, most graph learning models are tailored for static graphs. However, graphs usually evolve continually in the real world. Catastrophic forgetting also emerges in graph learning models when being trained incrementally. This leads to the need to develop robust, effective and efficient continual graph learning approaches. Continual graph learning (CGL) is an emerging area aiming to realize continual learning on graph-structured data. This survey is written to shed light on this emerging area. It introduces the basic concepts of CGL and highlights two unique challenges brought by graphs. Then it reviews and categorizes recent state-of-the-art approaches, analyzing their strategies to tackle the unique challenges in CGL. Besides, it discusses the main concerns in each family of CGL methods, offering potential solutions. Finally, it explores the open issues and potential applications of CGL.  ( 2 min )

Predicting how different interventions will causally affect a specific individual is important in a variety of domains such as personalized medicine, public policy, and online marketing. However, most existing causal methods cannot generalize to predicting the effects of previously unseen interventions (e.g., a newly invented drug), because they require data for individuals who received the intervention. Here, we consider zero-shot causal learning: predicting the personalized effects of novel, previously unseen interventions. To tackle this problem, we propose CaML, a causal meta-learning framework which formulates the personalized prediction of each intervention's effect as a task. Rather than training a separate model for each intervention, CaML trains as a single meta-model across thousands of tasks, each constructed by sampling an intervention and individuals who either did or did not receive it. By leveraging both intervention information (e.g., a drug's attributes) and individual features (e.g., a patient's history), CaML is able to predict the personalized effects of unseen interventions. Experimental results on real world datasets in large-scale medical claims and cell-line perturbations demonstrate the effectiveness of our approach. Most strikingly, CaML zero-shot predictions outperform even strong baselines which have direct access to data of considered target interventions.  ( 2 min )

Optimal control of diffusion processes is intimately connected to the problem of solving certain Hamilton-Jacobi-Bellman equations. Building on recent machine learning inspired approaches towards high-dimensional PDEs, we investigate the potential of $\textit{iterative diffusion optimisation}$ techniques, in particular considering applications in importance sampling and rare event simulation, and focusing on problems without diffusion control, with linearly controlled drift and running costs that depend quadratically on the control. More generally, our methods apply to nonlinear parabolic PDEs with a certain shift invariance. The choice of an appropriate loss function being a central element in the algorithmic design, we develop a principled framework based on divergences between path measures, encompassing various existing methods. Motivated by connections to forward-backward SDEs, we propose and study the novel $\textit{log-variance}$ divergence, showing favourable properties of corresponding Monte Carlo estimators. The promise of the developed approach is exemplified by a range of high-dimensional and metastable numerical examples.  ( 2 min )

Should we care whether AI systems have representations of the world that are similar to those of humans? We provide an information-theoretic analysis that suggests that there should be a U-shaped relationship between the degree of representational alignment with humans and performance on few-shot learning tasks. We confirm this prediction empirically, finding such a relationship in an analysis of the performance of 491 computer vision models. We also show that highly-aligned models are more robust to both adversarial attacks and domain shifts. Our results suggest that human-alignment is often a sufficient, but not necessary, condition for models to make effective use of limited data, be robust, and generalize well.  ( 2 min )

The high dimensionality and complex dynamics of turbulent flows remain an obstacle to the discovery and implementation of control strategies. Deep reinforcement learning (RL) is a promising avenue for overcoming these obstacles, but requires a training phase in which the RL agent iteratively interacts with the flow environment to learn a control policy, which can be prohibitively expensive when the environment involves slow experiments or large-scale simulations. We overcome this challenge using a framework we call "DManD-RL" (data-driven manifold dynamics-RL), which generates a data-driven low-dimensional model of our system that we use for RL training. With this approach, we seek to minimize drag in a direct numerical simulation (DNS) of a turbulent minimal flow unit of plane Couette flow at Re=400 using two slot jets on one wall. We obtain, from DNS data with $\mathcal{O}(10^5)$ degrees of freedom, a 25-dimensional DManD model of the dynamics by combining an autoencoder and neural ordinary differential equation. Using this model as the environment, we train an RL control agent, yielding a 440-fold speedup over training on the DNS, with equivalent control performance. The agent learns a policy that laminarizes 84% of unseen DNS test trajectories within 900 time units, significantly outperforming classical opposition control (58%), despite the actuation authority being much more restricted. The agent often achieves laminarization through a counterintuitive strategy that drives the formation of two low-speed streaks, with a spanwise wavelength that is too small to be self-sustaining. The agent demonstrates the same performance when we limit observations to wall shear rate.  ( 2 min )

Reinforcement learning (RL) agents typically learn tabula rasa, without prior knowledge of the world, which makes learning complex tasks with sparse rewards difficult. If initialized with knowledge of high-level subgoals and transitions between subgoals, RL agents could utilize this Abstract World Model (AWM) for planning and exploration. We propose using few-shot large language models (LLMs) to hypothesize an AWM, that is tested and verified during exploration, to improve sample efficiency in embodied RL agents. Our DECKARD agent applies LLM-guided exploration to item crafting in Minecraft in two phases: (1) the Dream phase where the agent uses an LLM to decompose a task into a sequence of subgoals, the hypothesized AWM; and (2) the Wake phase where the agent learns a modular policy for each subgoal and verifies or corrects the hypothesized AWM on the basis of its experiences. Our method of hypothesizing an AWM with LLMs and then verifying the AWM based on agent experience not only increases sample efficiency over contemporary methods by an order of magnitude but is also robust to and corrects errors in the LLM, successfully blending noisy internet-scale information from LLMs with knowledge grounded in environment dynamics.  ( 2 min )

Due to its simple installation and connectivity, the Internet of Things (IoT) is susceptible to malware attacks. Being able to operate autonomously. As IoT devices have become more prevalent, they have become the most tempting targets for malware. Weak, guessable, or hard-coded passwords, and a lack of security measures contribute to these vulnerabilities along with insecure network connections and outdated update procedures. To understand IoT malware, current methods and analysis ,using static methods, are ineffective. The field of deep learning has made great strides in recent years due to their tremendous data mining, learning, and expression capabilities, cybersecurity has enjoyed tremendous growth in recent years. As a result, malware analysts will not have to spend as much time analyzing malware. In this paper, we propose a novel detection and analysis method that harnesses the power and simplicity of decision trees. The experiments are conducted using a real word dataset, MaleVis which is a publicly available dataset. Based on the results, we show that our proposed approach outperforms existing state-of-the-art solutions in that it achieves 97.23% precision and 95.89% recall in terms of detection and classification. A specificity of 96.58%, F1-score of 96.40%, an accuracy of 96.43.  ( 2 min )

Pre-training methods on proteins are recently gaining interest, leveraging either protein sequences or structures, while modeling their joint energy landscape is largely unexplored. In this work, inspired by the success of denoising diffusion models, we propose the DiffPreT approach to pre-train a protein encoder by sequence-structure multimodal diffusion modeling. DiffPreT guides the encoder to recover the native protein sequences and structures from the perturbed ones along the multimodal diffusion trajectory, which acquires the joint distribution of sequences and structures. Considering the essential protein conformational variations, we enhance DiffPreT by a physics-inspired method called Siamese Diffusion Trajectory Prediction (SiamDiff) to capture the correlation between different conformers of a protein. SiamDiff attains this goal by maximizing the mutual information between representations of diffusion trajectories of structurally-correlated conformers. We study the effectiveness of DiffPreT and SiamDiff on both atom- and residue-level structure-based protein understanding tasks. Experimental results show that the performance of DiffPreT is consistently competitive on all tasks, and SiamDiff achieves new state-of-the-art performance, considering the mean ranks on all tasks. The source code will be released upon acceptance.  ( 2 min )

Early detection of many life-threatening diseases (e.g., prostate and breast cancer) within at-risk population can improve clinical outcomes and reduce cost of care. While numerous disease-specific "screening" tests that are closer to Point-of-Care (POC) are in use for this task, their low specificity results in unnecessary biopsies, leading to avoidable patient trauma and wasteful healthcare spending. On the other hand, despite the high accuracy of Magnetic Resonance (MR) imaging in disease diagnosis, it is not used as a POC disease identification tool because of poor accessibility. The root cause of poor accessibility of MR stems from the requirement to reconstruct high-fidelity images, as it necessitates a lengthy and complex process of acquiring large quantities of high-quality k-space measurements. In this study we explore the feasibility of an ML-augmented MR pipeline that directly infers the disease sidestepping the image reconstruction process. We hypothesise that the disease classification task can be solved using a very small tailored subset of k-space data, compared to image reconstruction. Towards that end, we propose a method that performs two tasks: 1) identifies a subset of the k-space that maximizes disease identification accuracy, and 2) infers the disease directly using the identified k-space subset, bypassing the image reconstruction step. We validate our hypothesis by measuring the performance of the proposed system across multiple diseases and anatomies. We show that comparable performance to image-based classifiers, trained on images reconstructed with full k-space data, can be achieved using small quantities of data: 8% of the data for detecting multiple abnormalities in prostate and brain scans, and 5% of the data for knee abnormalities. To better understand the proposed approach and instigate future research, we provide an extensive analysis and release code.  ( 2 min )

The reaction center consists of atoms in the product whose local properties are not identical to the corresponding atoms in the reactants. Prior studies on reaction center identification are mainly on semi-templated retrosynthesis methods. Moreover, they are limited to single reaction center identification. However, many reaction centers are comprised of multiple bonds or atoms in reality. We refer to it as the multiple reaction center. This paper presents RCsearcher, a unified framework for single and multiple reaction center identification that combines the advantages of the graph neural network and deep reinforcement learning. The critical insight in this framework is that the single or multiple reaction center must be a node-induced subgraph of the molecular product graph. At each step, it considers choosing one node in the molecular product graph and adding it to the explored node-induced subgraph as an action. Comprehensive experiments demonstrate that RCsearcher consistently outperforms other baselines and can extrapolate the reaction center patterns that have not appeared in the training set. Ablation experiments verify the effectiveness of individual components, including the beam search and one-hop constraint of action space.  ( 2 min )

While acute stress has been shown to have both positive and negative effects on performance, not much is known about the impacts of stress on students grades during examinations. To answer this question, we examined whether a correlation could be found between physiological stress signals and exam performance. We conducted this study using multiple physiological signals of ten undergraduate students over three different exams. The study focused on three signals, i.e., skin temperature, heart rate, and electrodermal activity. We extracted statistics as features and fed them into a variety of binary classifiers to predict relatively higher or lower grades. Experimental results showed up to 0.81 ROC-AUC with k-nearest neighbor algorithm among various machine learning algorithms.  ( 2 min )

Continual learning aims to avoid catastrophic forgetting and effectively leverage learned experiences to master new knowledge. Existing gradient projection approaches impose hard constraints on the optimization space for new tasks to minimize interference, which simultaneously hinders forward knowledge transfer. To address this issue, recent methods reuse frozen parameters with a growing network, resulting in high computational costs. Thus, it remains a challenge whether we can improve forward knowledge transfer for gradient projection approaches using a fixed network architecture. In this work, we propose the Restricted Orthogonal Gradient prOjection (ROGO) framework. The basic idea is to adopt a restricted orthogonal constraint allowing parameters optimized in the direction oblique to the whole frozen space to facilitate forward knowledge transfer while consolidating previous knowledge. Our framework requires neither data buffers nor extra parameters. Extensive experiments have demonstrated the superiority of our framework over several strong baselines. We also provide theoretical guarantees for our relaxing strategy.  ( 2 min )

Current protein language models (PLMs) learn protein representations mainly based on their sequences, thereby well capturing co-evolutionary information, but they are unable to explicitly acquire protein functions, which is the end goal of protein representation learning. Fortunately, for many proteins, their textual property descriptions are available, where their various functions are also described. Motivated by this fact, we first build the ProtDescribe dataset to augment protein sequences with text descriptions of their functions and other important properties. Based on this dataset, we propose the ProtST framework to enhance Protein Sequence pre-training and understanding by biomedical Texts. During pre-training, we design three types of tasks, i.e., unimodal mask prediction, multimodal representation alignment and multimodal mask prediction, to enhance a PLM with protein property information with different granularities and, at the same time, preserve the PLM's original representation power. On downstream tasks, ProtST enables both supervised learning and zero-shot prediction. We verify the superiority of ProtST-induced PLMs over previous ones on diverse representation learning benchmarks. Under the zero-shot setting, we show the effectiveness of ProtST on zero-shot protein classification, and ProtST also enables functional protein retrieval from a large-scale database without any function annotation.  ( 2 min )

To perform well, Deep Reinforcement Learning (DRL) methods require significant memory resources and computational time. Also, sometimes these systems need additional environment information to achieve a good reward. However, it is more important for many applications and devices to reduce memory usage and computational times than to achieve the maximum reward. This paper presents a modified DRL method that performs reasonably well with compressed imagery data without requiring additional environment information and also uses less memory and time. We have designed a lightweight Convolutional Neural Network (CNN) with a variant of the Q-network that efficiently takes preprocessed image data as input and uses less memory. Furthermore, we use a simple reward mechanism and small experience replay memory so as to provide only the minimum necessary information. Our modified DRL method enables our autonomous agent to play Snake, a classical control game. The results show our model can achieve similar performance as other DRL methods.  ( 2 min )

Recent ODE/SDE-based generative models, such as diffusion models and flow matching, define a generative process as a time reversal of a fixed forward process. Even though these models show impressive performance on large-scale datasets, numerical simulation requires multiple evaluations of a neural network, leading to a slow sampling speed. We attribute the reason to the high curvature of the learned generative trajectories, as it is directly related to the truncation error of a numerical solver. Based on the relationship between the forward process and the curvature, here we present an efficient method of training the forward process to minimize the curvature of generative trajectories without any ODE/SDE simulation. Experiments show that our method achieves a lower curvature than previous models and, therefore, decreased sampling costs while maintaining competitive performance. Code is available at https://github.com/sangyun884/fast-ode.  ( 2 min )

Differential equations are used to model and predict the behaviour of complex systems in a wide range of fields, and the ability to solve them is an important asset for understanding and predicting the behaviour of these systems. Complicated physics mostly involves difficult differential equations, which are hard to solve analytically. In recent years, physics-informed neural networks have been shown to perform very well in solving systems with various differential equations. The main ways to approximate differential equations are through penalty function and reparameterization. Most researchers use penalty functions rather than reparameterization due to the complexity of implementing reparameterization. In this study, we quantitatively compare physics-informed neural network models with and without reparameterization using the approximation error. The performance of reparameterization is demonstrated based on two benchmark mechanical engineering problems, a one-dimensional bar problem and a two-dimensional bending beam problem. Our results show that when dealing with complex differential equations, applying reparameterization results in a lower approximation error.  ( 2 min )

This paper introduces a computational framework to reconstruct and forecast a partially observed state that evolves according to an unknown or expensive-to-simulate dynamical system. Our reduced-order autodifferentiable ensemble Kalman filters (ROAD-EnKFs) learn a latent low-dimensional surrogate model for the dynamics and a decoder that maps from the latent space to the state space. The learned dynamics and decoder are then used within an ensemble Kalman filter to reconstruct and forecast the state. Numerical experiments show that if the state dynamics exhibit a hidden low-dimensional structure, ROAD-EnKFs achieve higher accuracy at lower computational cost compared to existing methods. If such structure is not expressed in the latent state dynamics, ROAD-EnKFs achieve similar accuracy at lower cost, making them a promising approach for surrogate state reconstruction and forecasting.  ( 2 min )

A temporal point process (TPP) is a stochastic process where its realization is a sequence of discrete events in time. Recent work in TPPs model the process using a neural network in a supervised learning framework, where a training set is a collection of all the sequences. In this work, we propose to train TPPs in a meta learning framework, where each sequence is treated as a different task, via a novel framing of TPPs as neural processes (NPs). We introduce context sets to model TPPs as an instantiation of NPs. Motivated by attentive NP, we also introduce local history matching to help learn more informative features. We demonstrate the potential of the proposed method on popular public benchmark datasets and tasks, and compare with state-of-the-art TPP methods.  ( 2 min )

Model-based methods have recently shown great potential for off-policy evaluation (OPE); offline trajectories induced by behavioral policies are fitted to transitions of Markov decision processes (MDPs), which are used to rollout simulated trajectories and estimate the performance of policies. Model-based OPE methods face two key challenges. First, as offline trajectories are usually fixed, they tend to cover limited state and action space. Second, the performance of model-based methods can be sensitive to the initialization of their parameters. In this work, we propose the variational latent branching model (VLBM) to learn the transition function of MDPs by formulating the environmental dynamics as a compact latent space, from which the next states and rewards are then sampled. Specifically, VLBM leverages and extends the variational inference framework with the recurrent state alignment (RSA), which is designed to capture as much information underlying the limited training data, by smoothing out the information flow between the variational (encoding) and generative (decoding) part of VLBM. Moreover, we also introduce the branching architecture to improve the model's robustness against randomly initialized model weights. The effectiveness of the VLBM is evaluated on the deep OPE (DOPE) benchmark, from which the training trajectories are designed to result in varied coverage of the state-action space. We show that the VLBM outperforms existing state-of-the-art OPE methods in general.  ( 2 min )

Recent success of large-scale Contrastive Language-Image Pre-training (CLIP) has led to great promise in zero-shot semantic segmentation by transferring image-text aligned knowledge to pixel-level classification. However, existing methods usually require an additional image encoder or retraining/tuning the CLIP module. Here, we present a cost-effective strategy using text-prompt learning that keeps the entire CLIP module frozen while fully leveraging its rich information. Specifically, we propose a novel Zero-shot segmentation with Optimal Transport (ZegOT) method that matches multiple text prompts with frozen image embeddings through optimal transport, which allows each text prompt to efficiently focus on specific semantic attributes. Additionally, we propose Deep Local Feature Alignment (DLFA) that deeply aligns the text prompts with intermediate local feature of the frozen image encoder layers, which significantly boosts the zero-shot segmentation performance. Through extensive experiments on benchmark datasets, we show that our method achieves the state-of-the-art (SOTA) performance with only x7 lighter parameters compared to previous SOTA approaches.  ( 2 min )

The integration of constrained optimization models as components in deep networks has led to promising advances in both these domains. A primary challenge in this setting is backpropagation through the optimization mapping, which typically lacks a closed form. A common approach is unrolling, which relies on automatic differentiation through the operations of an iterative solver. While flexible and general, unrolling can encounter accuracy and efficiency issues in practice. These issues can be avoided by differentiating the optimization mapping analytically, but current frameworks impose rigid requirements on the optimization problem's form. This paper provides theoretical insights into the backpropagation of unrolled optimizers, which lead to a system for generating equivalent but efficiently solvable analytical models. Additionally, it proposes a unifying view of unrolling and analytical differentiation through constrained optimization mappings. Experiments over various structured prediction and decision-focused learning tasks illustrate the potential of the approach both computationally and in terms of enhanced expressiveness.  ( 2 min )

Understanding the loss of information in spectral analytics is a crucial first step towards finding root causes for failures and uncertainties using spectral data in artificial intelligence models built from modern complex data science applications. Here, we show from a very simple entropy model analysis with quantum statistics of spectral data, that the relative loss of information from dimensionality reduction due to projection of an initial five-dimensional state onto two-dimensional diagrams is less than one percent in the parameter range of small data sets with sample sizes on the order of few hundreds data samples. From our analysis, we also conclude that the density and expectation value of the entropy probability distribution increases with the sample number and sample size using artificial data models derived from random sampling Monte-Carlo simulation methods.  ( 2 min )

Graph Transformer (GT) recently has emerged as a new paradigm of graph learning algorithms, outperforming the previously popular Message Passing Neural Network (MPNN) on multiple benchmarks. Previous work (Kim et al., 2022) shows that with proper position embedding, GT can approximate MPNN arbitrarily well, implying that GT is at least as powerful as MPNN. In this paper, we study the inverse connection and show that MPNN with virtual node (VN), a commonly used heuristic with little theoretical understanding, is powerful enough to arbitrarily approximate the self-attention layer of GT. In particular, we first show that if we consider one type of linear transformer, the so-called Performer/Linear Transformer (Choromanski et al., 2020; Katharopoulos et al., 2020), then MPNN + VN with only O(1) depth and O(1) width can approximate a self-attention layer in Performer/Linear Transformer. Next, via a connection between MPNN + VN and DeepSets, we prove the MPNN + VN with O(n^d) width and O(1) depth can approximate the self-attention layer arbitrarily well, where d is the input feature dimension. Lastly, under some assumptions, we provide an explicit construction of MPNN + VN with O(1) width and O(n) depth approximating the self-attention layer in GT arbitrarily well. On the empirical side, we demonstrate that 1) MPNN + VN is a surprisingly strong baseline, outperforming GT on the recently proposed Long Range Graph Benchmark (LRGB) dataset, 2) our MPNN + VN improves over early implementation on a wide range of OGB datasets and 3) MPNN + VN outperforms Linear Transformer and MPNN on the climate modeling task.  ( 2 min )

Diagnosing and cleaning datasets are crucial for building robust machine learning systems. However, identifying problems within large-scale datasets with real-world distributions is difficult due to the presence of complex issues, such as label errors or under-representation of certain types. In this paper, we propose a novel approach for identifying problematic data by utilizing a largely ignored source of information: a relational structure of data in the feature-embedded space. We develop an efficient algorithm for detecting label errors and outlier data points based on the relational graph structure of the dataset. We further introduce a visualization tool for contextualizing data points, which can serve as an effective tool for interactively diagnosing datasets. We evaluate label error and out-of-distribution detection performances on large-scale image and language domain tasks, including ImageNet and GLUE benchmarks, and demonstrate the effectiveness of our approach for debugging datasets and building robust machine learning systems.  ( 2 min )

We present a new technique for the accelerated training of physics-informed neural networks (PINNs): discretely-trained PINNs (DT-PINNs). The repeated computation of partial derivative terms in the PINN loss functions via automatic differentiation during training is known to be computationally expensive, especially for higher-order derivatives. DT-PINNs are trained by replacing these exact spatial derivatives with high-order accurate numerical discretizations computed using meshless radial basis function-finite differences (RBF-FD) and applied via sparse-matrix vector multiplication. The use of RBF-FD allows for DT-PINNs to be trained even on point cloud samples placed on irregular domain geometries. Additionally, though traditional PINNs (vanilla-PINNs) are typically stored and trained in 32-bit floating-point (fp32) on the GPU, we show that for DT-PINNs, using fp64 on the GPU leads to significantly faster training times than fp32 vanilla-PINNs with comparable accuracy. We demonstrate the efficiency and accuracy of DT-PINNs via a series of experiments. First, we explore the effect of network depth on both numerical and automatic differentiation of a neural network with random weights and show that RBF-FD approximations of third-order accuracy and above are more efficient while being sufficiently accurate. We then compare the DT-PINNs to vanilla-PINNs on both linear and nonlinear Poisson equations and show that DT-PINNs achieve similar losses with 2-4x faster training times on a consumer GPU. Finally, we also demonstrate that similar results can be obtained for the PINN solution to the heat equation (a space-time problem) by discretizing the spatial derivatives using RBF-FD and using automatic differentiation for the temporal derivative. Our results show that fp64 DT-PINNs offer a superior cost-accuracy profile to fp32 vanilla-PINNs.  ( 3 min )

Many variants of the Wasserstein distance have been introduced to reduce its original computational burden. In particular the Sliced-Wasserstein distance (SW), which leverages one-dimensional projections for which a closed-form solution of the Wasserstein distance is available, has received a lot of interest. Yet, it is restricted to data living in Euclidean spaces, while the Wasserstein distance has been studied and used recently on manifolds. We focus more specifically on the sphere, for which we define a novel SW discrepancy, which we call spherical Sliced-Wasserstein, making a first step towards defining SW discrepancies on manifolds. Our construction is notably based on closed-form solutions of the Wasserstein distance on the circle, together with a new spherical Radon transform. Along with efficient algorithms and the corresponding implementations, we illustrate its properties in several machine learning use cases where spherical representations of data are at stake: sampling on the sphere, density estimation on real earth data or hyperspherical auto-encoders.  ( 2 min )

Prior work has provided strong evidence that, within organizational settings, teams that bring a diversity of information and perspectives to a task are more effective than teams that do not. If this form of informational diversity confers performance advantages, why do we often see largely homogeneous teams in practice? One canonical argument is that the benefits of informational diversity are in tension with affinity bias. To better understand the impact of this tension on the makeup of teams, we analyze a sequential model of team formation in which individuals care about their team's performance (captured in terms of accurately predicting some future outcome based on a set of features) but experience a cost as a result of interacting with teammates who use different approaches to the prediction task. Our analysis of this simple model reveals a set of subtle behaviors that team-growth dynamics can exhibit: (i) from certain initial team compositions, they can make progress toward better performance but then get stuck partway to optimally diverse teams; while (ii) from other initial compositions, they can also move away from this optimal balance as the majority group tries to crowd out the opinions of the minority. The initial composition of the team can determine whether the dynamics will move toward or away from performance optimality, painting a path-dependent picture of inefficiencies in team compositions. Our results formalize a fundamental limitation of utility-based motivations to drive informational diversity in organizations and hint at interventions that may improve informational diversity and performance simultaneously.  ( 2 min )

We consider the stochastic linear contextual bandit problem with high-dimensional features. We analyze the Thompson sampling algorithm using special classes of sparsity-inducing priors (e.g., spike-and-slab) to model the unknown parameter and provide a nearly optimal upper bound on the expected cumulative regret. To the best of our knowledge, this is the first work that provides theoretical guarantees of Thompson sampling in high-dimensional and sparse contextual bandits. For faster computation, we use variational inference instead of Markov Chain Monte Carlo (MCMC) to approximate the posterior distribution. Extensive simulations demonstrate the improved performance of our proposed algorithm over existing ones.  ( 2 min )

Correctly identifying the type of file under examination is a critical part of a forensic investigation. The file type alone suggests the embedded content, such as a picture, video, manuscript, spreadsheet, etc. In cases where a system owner might desire to keep their files inaccessible or file type concealed, we propose using an adversarially-trained machine learning neural network to determine a file's true type even if the extension or file header is obfuscated to complicate its discovery. Our semi-supervised generative adversarial network (SGAN) achieved 97.6% accuracy in classifying files across 11 different types. We also compared our network against a traditional standalone neural network and three other machine learning algorithms. The adversarially-trained network proved to be the most precise file classifier especially in scenarios with few supervised samples available. Our implementation of a file classifier using an SGAN is implemented on GitHub (https://ksaintg.github.io/SGAN-File-Classier).  ( 2 min )

Accurate detection of brain tumors could save lots of lives and increasing the accuracy of this binary classification even as much as a few percent has high importance. Neural Gas Networks (NGN) is a fast, unsupervised algorithm that could be used in data clustering, image pattern recognition, and image segmentation. In this research, we used the metaheuristic Firefly Algorithm (FA) for image contrast enhancement as pre-processing and NGN weights for feature extraction and segmentation of Magnetic Resonance Imaging (MRI) data on two brain tumor datasets from the Kaggle platform. Also, tumor classification is conducted by Support Vector Machine (SVM) classification algorithms and compared with a deep learning technique plus other features in train and test phases. Additionally, NGN tumor segmentation is evaluated by famous performance metrics such as Accuracy, F-measure, Jaccard, and more versus ground truth data and compared with traditional segmentation techniques. The proposed method is fast and precise in both tasks of tumor classification and segmentation compared with other methods. A classification accuracy of 95.14 % and segmentation accuracy of 0.977 is achieved by the proposed method.  ( 2 min )

The symbolic music modality is nowadays mostly represented as discrete and used with sequential models such as Transformers, for deep learning tasks. Recent research put efforts on the tokenization, i.e. the conversion of data into sequences of integers intelligible to such models. This can be achieved by many ways as music can be composed of simultaneous tracks, of simultaneous notes with several attributes. Until now, the proposed tokenizations are based on small vocabularies describing the note attributes and time events, resulting in fairly long token sequences. In this paper, we show how Byte Pair Encoding (BPE) can improve the results of deep learning models while improving its performances. We experiment on music generation and composer classification, and study the impact of BPE on how models learn the embeddings, and show that it can help to increase their isotropy, i.e., the uniformity of the variance of their positions in the space.  ( 2 min )

This article introduces a method of evaluating subsamples until any prescribed level of classification accuracy is attained, thus obtaining arbitrary accuracy. A logarithmic reduction in error rate is obtained with a linear increase in sample count. The technique is applied to specific emitter identification on a published dataset of physically recorded over-the-air signals from 16 ostensibly identical high-performance radios. The technique uses a multi-channel deep learning convolutional neural network acting on the bispectra of I/Q signal subsamples each consisting of 56 parts per million (ppm) of the original signal duration. High levels of accuracy are obtained with minimal computation time: in this application, each addition of eight samples decreases error by one order of magnitude.  ( 2 min )

We propose a novel, fully nonparametric approach for the multi-task learning, the Multi-task Highly Adaptive Lasso (MT-HAL). MT-HAL simultaneously learns features, samples and task associations important for the common model, while imposing a shared sparse structure among similar tasks. Given multiple tasks, our approach automatically finds a sparse sharing structure. The proposed MTL algorithm attains a powerful dimension-free convergence rate of $o_p(n^{-1/4})$ or better. We show that MT-HAL outperforms sparsity-based MTL competitors across a wide range of simulation studies, including settings with nonlinear and linear relationships, varying levels of sparsity and task correlations, and different numbers of covariates and sample size.  ( 2 min )

The Computer-aided Diagnosis or Detection (CAD) approach for skin lesion analysis is an emerging field of research that has the potential to alleviate the burden and cost of skin cancer screening. Researchers have recently indicated increasing interest in developing such CAD systems, with the intention of providing a user-friendly tool to dermatologists to reduce the challenges encountered or associated with manual inspection. This article aims to provide a comprehensive literature survey and review of a total of 594 publications (356 for skin lesion segmentation and 238 for skin lesion classification) published between 2011 and 2022. These articles are analyzed and summarized in a number of different ways to contribute vital information regarding the methods for the development of CAD systems. These ways include relevant and essential definitions and theories, input data (dataset utilization, preprocessing, augmentations, and fixing imbalance problems), method configuration (techniques, architectures, module frameworks, and losses), training tactics (hyperparameter settings), and evaluation criteria. We intend to investigate a variety of performance-enhancing approaches, including ensemble and post-processing. We also discuss these dimensions to reveal their current trends based on utilization frequencies. In addition, we highlight the primary difficulties associated with evaluating skin lesion segmentation and classification systems using minimal datasets, as well as the potential solutions to these difficulties. Findings, recommendations, and trends are disclosed to inform future research on developing an automated and robust CAD system for skin lesion analysis.  ( 2 min )

Decentralized learning over distributed datasets can have significantly different data distributions across the agents. The current state-of-the-art decentralized algorithms mostly assume the data distributions to be Independent and Identically Distributed. This paper focuses on improving decentralized learning over non-IID data. We propose \textit{Neighborhood Gradient Clustering (NGC)}, a novel decentralized learning algorithm that modifies the local gradients of each agent using self- and cross-gradient information. Cross-gradients for a pair of neighboring agents are the derivatives of the model parameters of an agent with respect to the dataset of the other agent. In particular, the proposed method replaces the local gradients of the model with the weighted mean of the self-gradients, model-variant cross-gradients (derivatives of the neighbors' parameters with respect to the local dataset), and data-variant cross-gradients (derivatives of the local model with respect to its neighbors' datasets). The data-variant cross-gradients are aggregated through an additional communication round without breaking the privacy constraints. Further, we present \textit{CompNGC}, a compressed version of \textit{NGC} that reduces the communication overhead by $32 \times$. We theoretically analyze the convergence rate of the proposed algorithm and demonstrate its efficiency over non-IID data sampled from {various vision and language} datasets trained. Our experiments demonstrate that \textit{NGC} and \textit{CompNGC} outperform (by $0-6\%$) the existing SoTA decentralized learning algorithm over non-IID data with significantly less compute and memory requirements. Further, our experiments show that the model-variant cross-gradient information available locally at each agent can improve the performance over non-IID data by $1-35\%$ without additional communication cost.  ( 3 min )

Iterative methods are ubiquitous in large-scale scientific computing applications, and a number of approaches based on meta-learning have been recently proposed to accelerate them. However, a systematic study of these approaches and how they differ from meta-learning is lacking. In this paper, we propose a framework to analyze such learning-based acceleration approaches, where one can immediately identify a departure from classical meta-learning. We show that this departure may lead to arbitrary deterioration of model performance. Based on our analysis, we introduce a novel training method for learning-based acceleration of iterative methods. Furthermore, we theoretically prove that the proposed method improves upon the existing methods, and demonstrate its significant advantage and versatility through various numerical applications.  ( 2 min )

Ridgelet transform has been a fundamental mathematical tool in the theoretical studies of neural networks. However, the practical applicability of ridgelet transform to conducting learning tasks was limited since its numerical implementation by conventional classical computation requires an exponential runtime $\exp(O(D))$ as data dimension $D$ increases. To address this problem, we develop a quantum ridgelet transform (QRT), which implements the ridgelet transform of a quantum state within a linear runtime $O(D)$ of quantum computation. As an application, we also show that one can use QRT as a fundamental subroutine for quantum machine learning (QML) to efficiently find a sparse trainable subnetwork of large shallow wide neural networks without conducting large-scale optimization of the original network. This application discovers an efficient way in this regime to demonstrate the lottery ticket hypothesis on finding such a sparse trainable neural network. These results open an avenue of QML for accelerating learning tasks with commonly used classical neural networks.  ( 2 min )

Despite the popularity and efficacy of knowledge distillation, there is limited understanding of why it helps. In order to study the generalization behavior of a distilled student, we propose a new theoretical framework that leverages supervision complexity: a measure of alignment between teacher-provided supervision and the student's neural tangent kernel. The framework highlights a delicate interplay among the teacher's accuracy, the student's margin with respect to the teacher predictions, and the complexity of the teacher predictions. Specifically, it provides a rigorous justification for the utility of various techniques that are prevalent in the context of distillation, such as early stopping and temperature scaling. Our analysis further suggests the use of online distillation, where a student receives increasingly more complex supervision from teachers in different stages of their training. We demonstrate efficacy of online distillation and validate the theoretical findings on a range of image classification benchmarks and model architectures.  ( 2 min )

Diffusion-weighted magnetic resonance imaging is sensitive to the microstructural properties of brain tissue. However, estimating clinically and scientifically relevant microstructural properties from the measured signals remains a highly challenging inverse problem that deep learning may help solve. This study investigated if recently developed orientationally invariant spherical convolutional neural networks can improve microstructural parameter estimation. A spherical convolutional neural network was trained to predict the ground-truth parameter values from simulated noisy data and applied to imaging data acquired in a clinical setting to generate microstructural parameter maps. The spherical convolutional neural network was more accurate and less orientationally variant than the benchmark methods (multi-layer perceptrons and the spherical mean technique). Our results show that spherical convolutional neural networks can be a compelling alternative to predicting parameters from powder-averaged data (i.e., data averaged over the acquired diffusion encoding directions). While we focused on constrained two- and three-compartment models of neuronal tissue, the presented network and training pipeline are generalizable and can be used to estimate the parameters of other Gaussian compartment models.  ( 2 min )

Graph neural networks (GNNs) have been widely used under semi-supervised settings. Prior studies have mainly focused on finding appropriate graph filters (e.g., aggregation schemes) to generalize well for both homophilic and heterophilic graphs. Even though these approaches are essential and effective, they still suffer from the sparsity in initial node features inherent in the bag-of-words representation. Common in semi-supervised learning where the training samples often fail to cover the entire dimensions of graph filters (hyperplanes), this can precipitate over-fitting of specific dimensions in the first projection matrix. To deal with this problem, we suggest a simple and novel strategy; create additional space by flipping the initial features and hyperplane simultaneously. Training in both the original and in the flip space can provide precise updates of learnable parameters. To the best of our knowledge, this is the first attempt that effectively moderates the overfitting problem in GNN. Extensive experiments on real-world datasets demonstrate that the proposed technique improves the node classification accuracy up to 40.2 %  ( 2 min )

Near-term quantum computers provide a promising platform for finding ground states of quantum systems, which is an essential task in physics, chemistry, and materials science. Near-term approaches, however, are constrained by the effects of noise as well as the limited resources of near-term quantum hardware. We introduce "neural error mitigation," which uses neural networks to improve estimates of ground states and ground-state observables obtained using near-term quantum simulations. To demonstrate our method's broad applicability, we employ neural error mitigation to find the ground states of the H$_2$ and LiH molecular Hamiltonians, as well as the lattice Schwinger model, prepared via the variational quantum eigensolver (VQE). Our results show that neural error mitigation improves numerical and experimental VQE computations to yield low energy errors, high fidelities, and accurate estimations of more-complex observables like order parameters and entanglement entropy, without requiring additional quantum resources. Furthermore, neural error mitigation is agnostic with respect to the quantum state preparation algorithm used, the quantum hardware it is implemented on, and the particular noise channel affecting the experiment, contributing to its versatility as a tool for quantum simulation.  ( 2 min )

This paper introduces a new simulation-based inference procedure to model and sample from multi-dimensional probability distributions given access to i.i.d.\ samples, circumventing the usual approaches of explicitly modeling the density function or designing Markov chain Monte Carlo. Motivated by the seminal work on distance and isomorphism between metric measure spaces, we propose a new notion called the Reversible Gromov-Monge (RGM) distance and study how RGM can be used to design new transform samplers to perform simulation-based inference. Our RGM sampler can also estimate optimal alignments between two heterogeneous metric measure spaces $(\cX, \mu, c_{\cX})$ and $(\cY, \nu, c_{\cY})$ from empirical data sets, with estimated maps that approximately push forward one measure $\mu$ to the other $\nu$, and vice versa. We study the analytic properties of the RGM distance and derive that under mild conditions, RGM equals the classic Gromov-Wasserstein distance. Curiously, drawing a connection to Brenier's polar factorization, we show that the RGM sampler induces bias towards strong isomorphism with proper choices of $c_{\cX}$ and $c_{\cY}$. Statistical rate of convergence, representation, and optimization questions regarding the induced sampler are studied. Synthetic and real-world examples showcasing the effectiveness of the RGM sampler are also demonstrated.  ( 2 min )

Brain Computer Interface (BCI) technologies have the potential to improve the lives of millions of people around the world, whether through assistive technologies or clinical diagnostic tools. Despite advancements in the field, however, at present consumer and clinical viability remains low. A key reason for this is that many of the existing BCI deployments require substantial data collection per end-user, which can be cumbersome, tedious, and error-prone to collect. We address this challenge via a deep learning model, which, when trained across sufficient data from multiple subjects, offers reasonable performance out-of-the-box, and can be customized to novel subjects via a transfer learning process. We demonstrate the fundamental viability of our approach by repurposing an older but well-curated electroencephalography (EEG) dataset and benchmarking against several common approaches/techniques. We then partition this dataset into a transfer learning benchmark and demonstrate that our approach significantly reduces data collection burden per-subject. This suggests that our model and methodology may yield improvements to BCI technologies and enhance their consumer/clinical viability.  ( 2 min )

Noisy partial label learning (noisy PLL) is an important branch of weakly supervised learning. Unlike PLL where the ground-truth label must reside in the candidate set, noisy PLL relaxes this constraint and allows the ground-truth label may not be in the candidate set. To address this problem, existing works attempt to detect noisy samples and estimate the ground-truth label for each noisy sample. However, detection errors are inevitable, and these errors will accumulate during training and continuously affect model optimization. To address this challenge, we propose a novel framework for noisy PLL, called ``Dynamically Adjusted Label Importance (DALI)''. It aims to reduce the negative impact of detection errors by trading off the initial candidate set and model outputs with theoretical guarantees. Experimental results on multiple datasets demonstrate that our DALI succeeds over existing state-of-the-art approaches on noisy PLL. Our code will soon be publicly available.  ( 2 min )

Most existing methods to detect backdoored machine learning (ML) models take one of the two approaches: trigger inversion (aka. reverse engineer) and weight analysis (aka. model diagnosis). In particular, the gradient-based trigger inversion is considered to be among the most effective backdoor detection techniques, as evidenced by the TrojAI competition, Trojan Detection Challenge and backdoorBench. However, little has been done to understand why this technique works so well and, more importantly, whether it raises the bar to the backdoor attack. In this paper, we report the first attempt to answer this question by analyzing the change rate of the backdoored model around its trigger-carrying inputs. Our study shows that existing attacks tend to inject the backdoor characterized by a low change rate around trigger-carrying inputs, which are easy to capture by gradient-based trigger inversion. In the meantime, we found that the low change rate is not necessary for a backdoor attack to succeed: we design a new attack enhancement called \textit{Gradient Shaping} (GRASP), which follows the opposite direction of adversarial training to reduce the change rate of a backdoored model with regard to the trigger, without undermining its backdoor effect. Also, we provide a theoretic analysis to explain the effectiveness of this new technique and the fundamental weakness of gradient-based trigger inversion. Finally, we perform both theoretical and experimental analysis, showing that the GRASP enhancement does not reduce the effectiveness of the stealthy attacks against the backdoor detection methods based on weight analysis, as well as other backdoor mitigation methods without using detection.  ( 2 min )

Self-supervised learning (SSL) aims to learn intrinsic features without labels. Despite the diverse architectures of SSL methods, the projection head always plays an important role in improving the performance of the downstream task. In this work, we systematically investigate the role of the projection head in SSL. Specifically, the projection head targets the uniformity part of SSL, which pushes the dissimilar samples away from each other, thus enabling the encoder to focus on extracting semantic features. Based on this understanding, we propose a Representation Evaluation Design (RED) in SSL models in which a shortcut connection between the representation and the projection vectors is built. Extensive experiments with different architectures, including SimCLR, MoCo-V2, and SimSiam, on various datasets, demonstrate that the representation evaluation design can consistently improve the baseline models in the downstream tasks. The learned representation from the RED-SSL models shows superior robustness to unseen augmentations and out-of-distribution data.  ( 2 min )

Learning-based control approaches have shown great promise in performing complex tasks directly from high-dimensional perception data for real robotic systems. Nonetheless, the learned controllers can behave unexpectedly if the trajectories of the system divert from the training data distribution, which can compromise safety. In this work, we propose a control filter that wraps any reference policy and effectively encourages the system to stay in-distribution with respect to offline-collected safe demonstrations. Our methodology is inspired by Control Barrier Functions (CBFs), which are model-based tools from the nonlinear control literature that can be used to construct minimally invasive safe policy filters. While existing methods based on CBFs require a known low-dimensional state representation, our proposed approach is directly applicable to systems that rely solely on high-dimensional visual observations by learning in a latent state-space. We demonstrate that our method is effective for two different visuomotor control tasks in simulation environments, including both top-down and egocentric view settings.  ( 2 min )

Learning models that are robust to test-time distribution shifts is a key concern in domain generalization, and in the wider context of their real-life applicability. Invariant Risk Minimization (IRM) is one particular framework that aims to learn deep invariant features from multiple domains and has subsequently led to further variants. A key assumption for the success of these methods requires that the underlying causal mechanisms/features remain invariant across domains and the true invariant features be sufficient to learn the optimal predictor. In practical problem settings, these assumptions are often not satisfied, which leads to IRM learning a sub-optimal predictor for that task. In this work, we propose the notion of partial invariance as a relaxation of the IRM framework. Under our problem setting, we first highlight the sub-optimality of the IRM solution. We then demonstrate how partitioning the training domains, assuming access to some meta-information about the domains, can help improve the performance of invariant models via partial invariance. Finally, we conduct several experiments, both in linear settings as well as with classification tasks in language and images with deep models, which verify our conclusions.  ( 2 min )

Many existing reinforcement learning (RL) methods employ stochastic gradient iteration on the back end, whose stability hinges upon a hypothesis that the data-generating process mixes exponentially fast with a rate parameter that appears in the step-size selection. Unfortunately, this assumption is violated for large state spaces or settings with sparse rewards, and the mixing time is unknown, making the step size inoperable. In this work, we propose an RL methodology attuned to the mixing time by employing a multi-level Monte Carlo estimator for the critic, the actor, and the average reward embedded within an actor-critic (AC) algorithm. This method, which we call \textbf{M}ulti-level \textbf{A}ctor-\textbf{C}ritic (MAC), is developed especially for infinite-horizon average-reward settings and neither relies on oracle knowledge of the mixing time in its parameter selection nor assumes its exponential decay; it, therefore, is readily applicable to applications with slower mixing times. Nonetheless, it achieves a convergence rate comparable to the state-of-the-art AC algorithms. We experimentally show that these alleviated restrictions on the technical conditions required for stability translate to superior performance in practice for RL problems with sparse rewards.  ( 2 min )

Aerosol-cloud interactions (ACI) include various effects that result from aerosols entering a cloud, and affecting cloud properties. In general, an increase in aerosol concentration results in smaller droplet sizes which leads to larger, brighter, longer-lasting clouds that reflect more sunlight and cool the Earth. The strength of the effect is however heterogeneous, meaning it depends on the surrounding environment, making ACI one of the most uncertain effects in our current climate models. In our work, we use causal machine learning to estimate ACI from satellite observations by reframing the problem as a treatment (aerosol) and outcome (change in droplet radius). We predict the causal effect of aerosol on clouds with uncertainty bounds depending on the unknown factors that may be influencing the impact of aerosol. Of the three climate models evaluated, we find that only one plausibly recreates the trend, lending more credence to its estimate cooling due to ACI.  ( 2 min )

Statistical whitening transformations play a fundamental role in many computational systems, and may also play an important role in biological sensory systems. Individual neurons appear to rapidly and reversibly alter their input-output gains, approximately normalizing the variance of their responses. Populations of neurons appear to regulate their joint responses, reducing correlations between neural activities. It is natural to see whitening as the objective that guides these behaviors, but the mechanism for such joint changes is unknown, and direct adjustment of synaptic interactions would seem to be both too slow, and insufficiently reversible. Motivated by the extensive neuroscience literature on rapid gain modulation, we propose a recurrent network architecture in which joint whitening is achieved through modulation of gains within the circuit. Specifically, we derive an online statistical whitening algorithm that regulates the joint second-order statistics of a multi-dimensional input by adjusting the marginal variances of an overcomplete set of interneuron projections. The gains of these interneurons are adjusted individually, using only local signals, and feed back onto the primary neurons. The network converges to a state in which the responses of the primary neurons are whitened. We demonstrate through simulations that the behavior of the network is robust to poor conditioning or noise when the gains are sign-constrained, and can be generalized to achieve a form of local whitening in convolutional populations, such as those found throughout the visual or auditory system.  ( 2 min )

This work describes in detail how to learn and solve the Rubik's cube game (or puzzle) in the General Board Game (GBG) learning and playing framework. We cover the cube sizes 2x2x2 and 3x3x3. We describe in detail the cube's state representation, how to transform it with twists, whole-cube rotations and color transformations and explain the use of symmetries in Rubik's cube. Next, we discuss different n-tuple representations for the cube, how we train the agents by reinforcement learning and how we improve the trained agents during evaluation by MCTS wrapping. We present results for agents that learn Rubik's cube from scratch, with and without MCTS wrapping, with and without symmetries and show that both, MCTS wrapping and symmetries, increase computational costs, but lead at the same time to much better results. We can solve the 2x2x2 cube completely, and the 3x3x3 cube in the majority of the cases for scrambled cubes up to p = 15 (QTM). We cannot yet reliably solve 3x3x3 cubes with more than 15 scrambling twists. Although our computational costs are higher with MCTS wrapping and with symmetries than without, they are still considerably lower than in the approaches of McAleer et al. (2018, 2019) and Agostinelli et al. (2019) who provide the best Rubik's cube learning agents so far.  ( 2 min )

In recent years, there have been significant advances in the use of deep learning methods in inverse problems such as denoising, compressive sensing, inpainting, and super-resolution. While this line of works has predominantly been driven by practical algorithms and experiments, it has also given rise to a variety of intriguing theoretical problems. In this paper, we survey some of the prominent theoretical developments in this line of works, focusing in particular on generative priors, untrained neural network priors, and unfolding algorithms. In addition to summarizing existing results in these topics, we highlight several ongoing challenges and open problems.  ( 2 min )

Dynamic treatment rules or policies are a sequence of decision functions over multiple stages that are tailored to individual features. One important class of treatment policies for practice, namely multi-stage stationary treatment policies, prescribe treatment assignment probabilities using the same decision function over stages, where the decision is based on the same set of features consisting of both baseline variables (e.g., demographics) and time-evolving variables (e.g., routinely collected disease biomarkers). Although there has been extensive literature to construct valid inference for the value function associated with the dynamic treatment policies, little work has been done for the policies themselves, especially in the presence of high dimensional feature variables. We aim to fill in the gap in this work. Specifically, we first estimate the multistage stationary treatment policy based on an augmented inverse probability weighted estimator for the value function to increase the asymptotic efficiency, and further apply a penalty to select important feature variables. We then construct one-step improvement of the policy parameter estimators. Theoretically, we show that the improved estimators are asymptotically normal, even if nuisance parameters are estimated at a slow convergence rate and the dimension of the feature variables increases exponentially with the sample size. Our numerical studies demonstrate that the proposed method has satisfactory performance in small samples, and that the performance can be improved with a choice of the augmentation term that approximates the rewards or minimizes the variance of the value function.  ( 2 min )

Optimal control of diffusion processes is intimately connected to the problem of solving certain Hamilton-Jacobi-Bellman equations. Building on recent machine learning inspired approaches towards high-dimensional PDEs, we investigate the potential of $\textit{iterative diffusion optimisation}$ techniques, in particular considering applications in importance sampling and rare event simulation, and focusing on problems without diffusion control, with linearly controlled drift and running costs that depend quadratically on the control. More generally, our methods apply to nonlinear parabolic PDEs with a certain shift invariance. The choice of an appropriate loss function being a central element in the algorithmic design, we develop a principled framework based on divergences between path measures, encompassing various existing methods. Motivated by connections to forward-backward SDEs, we propose and study the novel $\textit{log-variance}$ divergence, showing favourable properties of corresponding Monte Carlo estimators. The promise of the developed approach is exemplified by a range of high-dimensional and metastable numerical examples.  ( 2 min )

Distributed stochastic optimization has drawn great attention recently due to its effectiveness in solving large-scale machine learning problems. However, despite that numerous algorithms have been proposed with empirical successes, their theoretical guarantees are restrictive and rely on certain boundedness conditions on the stochastic gradients, varying from uniform boundedness to the relaxed growth condition. In addition, how to characterize the data heterogeneity among the agents and its impacts on the algorithmic performance remains challenging. In light of such motivations, we revisit the classical FedAvg algorithm for solving the distributed stochastic optimization problem and establish the convergence results under only a mild variance condition on the stochastic gradients for smooth nonconvex objective functions. Almost sure convergence to a stationary point is also established under the condition. Moreover, we discuss a more informative measurement for data heterogeneity as well as its implications.  ( 2 min )

Stochastic linear contextual bandit algorithms have substantial applications in practice, such as recommender systems, online advertising, clinical trials, etc. Recent works show that optimal bandit algorithms are vulnerable to adversarial attacks and can fail completely in the presence of attacks. Existing robust bandit algorithms only work for the non-contextual setting under the attack of rewards and cannot improve the robustness in the general and popular contextual bandit environment. In addition, none of the existing methods can defend against attacked context. In this work, we provide the first robust bandit algorithm for stochastic linear contextual bandit setting under a fully adaptive and omniscient attack with sub-linear regret. Our algorithm not only works under the attack of rewards, but also under attacked context. Moreover, it does not need any information about the attack budget or the particular form of the attack. We provide theoretical guarantees for our proposed algorithm and show by experiments that our proposed algorithm improves the robustness against various kinds of popular attacks.  ( 2 min )

Batch reinforcement learning (RL) aims at finding an optimal policy in a dynamic environment in order to maximize the expected total rewards by leveraging pre-collected data. A fundamental challenge behind this task is the distributional mismatch between the batch data generating process and the distribution induced by target policies. Nearly all existing algorithms rely on the absolutely continuous assumption on the distribution induced by target policies with respect to the data distribution so that the batch data can be used to calibrate target policies via the change of measure. However, the absolute continuity assumption could be violated in practice, especially when the state-action space is large or continuous. In this paper, we propose a new batch RL algorithm without requiring absolute continuity in the setting of an infinite-horizon Markov decision process with continuous states and actions. We call our algorithm STEEL: SingulariTy-awarE rEinforcement Learning. Our algorithm is motivated by a new error analysis on off-policy evaluation, where we use maximum mean discrepancy, together with distributionally robust optimization, to characterize the error of off-policy evaluation caused by the possible singularity and to enable the power of model extrapolation. By leveraging the idea of pessimism and under some mild conditions, we derive a finite-sample regret guarantee for our proposed algorithm without imposing absolute continuity. Compared with existing algorithms, STEEL only requires some minimal data-coverage assumption and thus greatly enhances the applicability and robustness of batch RL. Extensive simulation studies and one real experiment on personalized pricing demonstrate the superior performance of our method when facing possible singularity in batch RL.  ( 2 min )

Many real-world domains require safe decision making in the presence of uncertainty. In this work, we propose a deep reinforcement learning framework for approaching this important problem. We consider a risk-averse perspective towards model uncertainty through the use of coherent distortion risk measures, and we show that our formulation is equivalent to a distributionally robust safe reinforcement learning problem with robustness guarantees on performance and safety. We propose an efficient implementation that only requires access to a single training environment, and we demonstrate that our framework produces robust, safe performance on a variety of continuous control tasks with safety constraints in the Real-World Reinforcement Learning Suite.  ( 2 min )

Stacking (or stacked generalization) is an ensemble learning method with one main distinctiveness from the rest: even though several base models are trained on the original data set, their predictions are further used as input data for one or more metamodels arranged in at least one extra layer. Composing a stack of models can produce high-performance outcomes, but it usually involves a trial-and-error process. Therefore, our previously developed visual analytics system, StackGenVis, was mainly designed to assist users in choosing a set of top-performing and diverse models by measuring their predictive performance. However, it only employs a single logistic regression metamodel. In this paper, we investigate the impact of alternative metamodels on the performance of stacking ensembles using a novel visualization tool, called MetaStackVis. Our interactive tool helps users to visually explore different singular and pairs of metamodels according to their predictive probabilities and multiple validation metrics, as well as their ability to predict specific problematic data instances. MetaStackVis was evaluated with a usage scenario based on a medical data set and via expert interviews.  ( 2 min )

State-of-the-art performance in electroencephalography (EEG) decoding tasks is currently often achieved with either Deep-Learning or Riemannian-Geometry-based decoders. Recently, there is growing interest in Deep Riemannian Networks (DRNs) possibly combining the advantages of both previous classes of methods. However, there are still a range of topics where additional insight is needed to pave the way for a more widespread application of DRNs in EEG. These include architecture design questions such as network size and end-to-end ability as well as model training questions. How these factors affect model performance has not been explored. Additionally, it is not clear how the data within these networks is transformed, and whether this would correlate with traditional EEG decoding. Our study aims to lay the groundwork in the area of these topics through the analysis of DRNs for EEG with a wide range of hyperparameters. Networks were tested on two public EEG datasets and compared with state-of-the-art ConvNets. Here we propose end-to-end EEG SPDNet (EE(G)-SPDNet), and we show that this wide, end-to-end DRN can outperform the ConvNets, and in doing so use physiologically plausible frequency regions. We also show that the end-to-end approach learns more complex filters than traditional band-pass filters targeting the classical alpha, beta, and gamma frequency bands of the EEG, and that performance can benefit from channel specific filtering approaches. Additionally, architectural analysis revealed areas for further improvement due to the possible loss of Riemannian specific information throughout the network. Our study thus shows how to design and train DRNs to infer task-related information from the raw EEG without the need of handcrafted filterbanks and highlights the potential of end-to-end DRNs such as EE(G)-SPDNet for high-performance EEG decoding.  ( 3 min )

We consider the stochastic linear contextual bandit problem with high-dimensional features. We analyze the Thompson sampling algorithm using special classes of sparsity-inducing priors (e.g., spike-and-slab) to model the unknown parameter and provide a nearly optimal upper bound on the expected cumulative regret. To the best of our knowledge, this is the first work that provides theoretical guarantees of Thompson sampling in high-dimensional and sparse contextual bandits. For faster computation, we use variational inference instead of Markov Chain Monte Carlo (MCMC) to approximate the posterior distribution. Extensive simulations demonstrate the improved performance of our proposed algorithm over existing ones.  ( 2 min )

We study nonlinear optimization problems with a stochastic objective and deterministic equality and inequality constraints, which emerge in numerous applications including finance, manufacturing, power systems and, recently, deep neural networks. We propose an active-set stochastic sequential quadratic programming (StoSQP) algorithm that utilizes a differentiable exact augmented Lagrangian as the merit function. The algorithm adaptively selects the penalty parameters of the augmented Lagrangian and performs a stochastic line search to decide the stepsize. The global convergence is established: for any initialization, the KKT residuals converge to zero almost surely. Our algorithm and analysis further develop the prior work of Na et al., (2022). Specifically, we allow nonlinear inequality constraints without requiring the strict complementary condition; refine some of the designs in Na et al., (2022) such as the feasibility error condition and the monotonically increasing sample size; strengthen the global convergence guarantee; and improve the sample complexity on the objective Hessian. We demonstrate the performance of the designed algorithm on a subset of nonlinear problems collected in CUTEst test set and on constrained logistic regression problems.  ( 2 min )

This paper considers the learning of logical (Boolean) functions with focus on the generalization on the unseen (GOTU) setting, a strong case of out-of-distribution generalization. This is motivated by the fact that the rich combinatorial nature of data in certain reasoning tasks (e.g., arithmetic/logic) makes representative data sampling challenging, and learning successfully under GOTU gives a first vignette of an 'extrapolating' or 'reasoning' learner. We then study how different network architectures trained by (S)GD perform under GOTU and provide both theoretical and experimental evidence that for a class of network models including instances of Transformers, random features models, and diagonal linear networks, a min-degree-interpolator (MDI) is learned on the unseen. We also provide evidence that other instances with larger learning rates or mean-field networks reach leaky MDIs. These findings lead to two implications: (1) we provide an explanation to the length generalization problem (e.g., Anil et al. 2022); (2) we introduce a curriculum learning algorithm called Degree-Curriculum that learns monomials more efficiently by incrementing supports.  ( 2 min )

Optimal transport is an important tool in machine learning, allowing to capture geometric properties of the data through a linear program on transport polytopes. We present a single-loop optimization algorithm for minimizing general convex objectives on these domains, utilizing the principles of Sinkhorn matrix scaling and mirror descent. The proposed algorithm is robust to noise, and can be used in an online setting. We provide theoretical guarantees for convex objectives and experimental results showcasing it effectiveness on both synthetic and real-world data.  ( 2 min )

In text-to-SQL task, seq-to-seq models often lead to sub-optimal performance due to limitations in their architecture. In this paper, we present a simple yet effective approach that adapts transformer-based seq-to-seq model to robust text-to-SQL generation. Instead of inducing constraint to decoder or reformat the task as slot-filling, we propose to train seq-to-seq model with Schema aware Denoising (SeaD), which consists of two denoising objectives that train model to either recover input or predict output from two novel erosion and shuffle noises. These denoising objectives acts as the auxiliary tasks for better modeling the structural data in S2S generation. In addition, we improve and propose a clause-sensitive execution guided (EG) decoding strategy to overcome the limitation of EG decoding for generative model. The experiments show that the proposed method improves the performance of seq-to-seq model in both schema linking and grammar correctness and establishes new state-of-the-art on WikiSQL benchmark. The results indicate that the capacity of vanilla seq-to-seq architecture for text-to-SQL may have been under-estimated.  ( 2 min )

An individualized decision rule (IDR) is a decision function that assigns each individual a given treatment based on his/her observed characteristics. Most of the existing works in the literature consider settings with binary or finitely many treatment options. In this paper, we focus on the continuous treatment setting and propose a jump interval-learning to develop an individualized interval-valued decision rule (I2DR) that maximizes the expected outcome. Unlike IDRs that recommend a single treatment, the proposed I2DR yields an interval of treatment options for each individual, making it more flexible to implement in practice. To derive an optimal I2DR, our jump interval-learning method estimates the conditional mean of the outcome given the treatment and the covariates via jump penalized regression, and derives the corresponding optimal I2DR based on the estimated outcome regression function. The regressor is allowed to be either linear for clear interpretation or deep neural network to model complex treatment-covariates interactions. To implement jump interval-learning, we develop a searching algorithm based on dynamic programming that efficiently computes the outcome regression function. Statistical properties of the resulting I2DR are established when the outcome regression function is either a piecewise or continuous function over the treatment space. We further develop a procedure to infer the mean outcome under the (estimated) optimal policy. Extensive simulations and a real data application to a warfarin study are conducted to demonstrate the empirical validity of the proposed I2DR.  ( 2 min )

Evaluating the performance of an ongoing policy plays a vital role in many areas such as medicine and economics, to provide crucial instruction on the early-stop of the online experiment and timely feedback from the environment. Policy evaluation in online learning thus attracts increasing attention by inferring the mean outcome of the optimal policy (i.e., the value) in real-time. Yet, such a problem is particularly challenging due to the dependent data generated in the online environment, the unknown optimal policy, and the complex exploration and exploitation trade-off in the adaptive experiment. In this paper, we aim to overcome these difficulties in policy evaluation for online learning. We explicitly derive the probability of exploration that quantifies the probability of exploring the non-optimal actions under commonly used bandit algorithms. We use this probability to conduct valid inference on the online conditional mean estimator under each action and develop the doubly robust interval estimation (DREAM) method to infer the value under the estimated optimal policy in online learning. The proposed value estimator provides double protection on the consistency and is asymptotically normal with a Wald-type confidence interval provided. Extensive simulations and real data applications are conducted to demonstrate the empirical validity of the proposed DREAM method.  ( 2 min )

Many variants of the Wasserstein distance have been introduced to reduce its original computational burden. In particular the Sliced-Wasserstein distance (SW), which leverages one-dimensional projections for which a closed-form solution of the Wasserstein distance is available, has received a lot of interest. Yet, it is restricted to data living in Euclidean spaces, while the Wasserstein distance has been studied and used recently on manifolds. We focus more specifically on the sphere, for which we define a novel SW discrepancy, which we call spherical Sliced-Wasserstein, making a first step towards defining SW discrepancies on manifolds. Our construction is notably based on closed-form solutions of the Wasserstein distance on the circle, together with a new spherical Radon transform. Along with efficient algorithms and the corresponding implementations, we illustrate its properties in several machine learning use cases where spherical representations of data are at stake: sampling on the sphere, density estimation on real earth data or hyperspherical auto-encoders.  ( 2 min )

Predictive algorithms, such as deep neural networks (DNNs), are used in many domain sciences to directly estimate internal parameters of interest in simulator-based models, especially in settings where the observations include images or other complex high-dimensional data. In parallel, modern neural density estimators, such as normalizing flows, are becoming increasingly popular for uncertainty quantification, especially when both parameters and observations are high-dimensional. However, parameter inference is an inverse problem and not a prediction task; thus, an open challenge is to construct conditionally valid and precise confidence regions, with a guaranteed probability of covering the true parameters of the data-generating process, no matter what the (unknown) parameter values are, and without relying on large-sample theory. Many simulator-based inference (SBI) methods are indeed known to produce biased or overly confident parameter regions, yielding misleading uncertainty estimates. This paper presents WALDO, a novel method for constructing confidence regions with finite-sample conditional validity by leveraging prediction algorithms or posterior estimators that are currently widely adopted in SBI. WALDO reframes the well-known Wald test statistic, and uses a computationally efficient regression-based machinery for classical Neyman inversion of hypothesis tests. We apply our method to a recent high-energy physics problem, where prediction with DNNs has previously led to estimates with prediction bias. We also illustrate how our approach can correct overly confident posterior regions computed with normalizing flows.  ( 2 min )

Quantum machine learning (QML) offers a powerful, flexible paradigm for programming near-term quantum computers, with applications in chemistry, metrology, materials science, data science, and mathematics. Here, one trains an ansatz, in the form of a parameterized quantum circuit, to accomplish a task of interest. However, challenges have recently emerged suggesting that deep ansatzes are difficult to train, due to flat training landscapes caused by randomness or by hardware noise. This motivates our work, where we present a variable structure approach to build ansatzes for QML. Our approach, called VAns (Variable Ansatz), applies a set of rules to both grow and (crucially) remove quantum gates in an informed manner during the optimization. Consequently, VAns is ideally suited to mitigate trainability and noise-related issues by keeping the ansatz shallow. We employ VAns in the variational quantum eigensolver for condensed matter and quantum chemistry applications, in the quantum autoencoder for data compression and in unitary compilation problems showing successful results in all cases.  ( 2 min )

Consider an online convex optimization problem where the loss functions are self-concordant barriers, smooth relative to a convex function $h$, and possibly non-Lipschitz. We analyze the regret of online mirror descent with $h$. Then, based on the result, we prove the following in a unified manner. Denote by $T$ the time horizon and $d$ the parameter dimension. 1. For online portfolio selection, the regret of $\widetilde{\text{EG}}$, a variant of exponentiated gradient due to Helmbold et al., is $\tilde{O} ( T^{2/3} d^{1/3} )$ when $T > 4 d / \log d$. This improves on the original $\tilde{O} ( T^{3/4} d^{1/2} )$ regret bound for $\widetilde{\text{EG}}$. 2. For online portfolio selection, the regret of online mirror descent with the logarithmic barrier is $\tilde{O}(\sqrt{T d})$. The regret bound is the same as that of Soft-Bayes due to Orseau et al. up to logarithmic terms. 3. For online learning quantum states with the logarithmic loss, the regret of online mirror descent with the log-determinant function is also $\tilde{O} ( \sqrt{T d} )$. Its per-iteration time is shorter than all existing algorithms we know.  ( 2 min )

Observational studies require adjustment for confounding factors that are correlated with both the treatment and outcome. In the setting where the observed variables are tabular quantities such as average income in a neighborhood, tools have been developed for addressing such confounding. However, in many parts of the developing world, features about local communities may be scarce. In this context, satellite imagery can play an important role, serving as a proxy for the confounding variables otherwise unobserved. In this paper, we study confounder adjustment in this non-tabular setting, where patterns or objects found in satellite images contribute to the confounder bias. Using the evaluation of anti-poverty aid programs in Africa as our running example, we formalize the challenge of performing causal adjustment with such unstructured data -- what conditions are sufficient to identify causal effects, how to perform estimation, and how to quantify the ways in which certain aspects of the unstructured image object are most predictive of the treatment decision. Via simulation, we also explore the sensitivity of satellite image-based observational inference to image resolution and to misspecification of the image-associated confounder. Finally, we apply these tools in estimating the effect of anti-poverty interventions in African communities from satellite imagery.  ( 2 min )

This paper outlines an end-to-end optimized lossy image compression framework using diffusion generative models. The approach relies on the transform coding paradigm, where an image is mapped into a latent space for entropy coding and, from there, mapped back to the data space for reconstruction. In contrast to VAE-based neural compression, where the (mean) decoder is a deterministic neural network, our decoder is a conditional diffusion model. Our approach thus introduces an additional ``content'' latent variable on which the reverse diffusion process is conditioned and uses this variable to store information about the image. The remaining ``texture'' latent variables characterizing the diffusion process are synthesized (stochastically or deterministically) at decoding time. We show that the model's performance can be tuned toward perceptual metrics of interest. Our extensive experiments involving five datasets and sixteen image quality assessment metrics show that our approach yields the strongest reported FID scores while also yielding competitive performance with state-of-the-art models in several SIM-based reference metrics.  ( 2 min )

Traditionally, the random noise is equally injected when training with different data instances in the field of differential privacy (DP). In this paper, we first give sharper excess risk bounds of DP stochastic gradient descent (SGD) method. Considering most of the previous methods are under convex conditions, we use Polyak-{\L}ojasiewicz condition to relax it in this paper. Then, after observing that different training data instances affect the machine learning model to different extent, we consider the heterogeneity of training data and attempt to improve the performance of DP-SGD from a new perspective. Specifically, by introducing the influence function (IF), we quantitatively measure the contributions of various training data on the final machine learning model. If the contribution made by a single data instance is so little that attackers cannot infer anything from the model, we do not add noise when training with it. Based on this observation, we design a `Performance Improving' DP-SGD algorithm: PIDP-SGD. Theoretical and experimental results show that our proposed PIDP-SGD improves the performance significantly.  ( 2 min )

We consider the estimation of two-sample integral functionals, of the type that occur naturally, for example, when the object of interest is a divergence between unknown probability densities. Our first main result is that, in wide generality, a weighted nearest neighbour estimator is efficient, in the sense of achieving the local asymptotic minimax lower bound. Moreover, we also prove a corresponding central limit theorem, which facilitates the construction of asymptotically valid confidence intervals for the functional, having asymptotically minimal width. One interesting consequence of our results is the discovery that, for certain functionals, the worst-case performance of our estimator may improve on that of the natural `oracle' estimator, which is given access to the values of the unknown densities at the observations.  ( 2 min )

This paper studies the problem of optimally allocating treatments in the presence of spillover effects, using information from a (quasi-)experiment. I introduce a method that maximizes the sample analog of average social welfare when spillovers occur. I construct semi-parametric welfare estimators with known and unknown propensity scores and cast the optimization problem into a mixed-integer linear program, which can be solved using off-the-shelf algorithms. I derive a strong set of guarantees on regret, i.e., the difference between the maximum attainable welfare and the welfare evaluated at the estimated policy. The proposed method presents attractive features for applications: (i) it does not require network information of the target population; (ii) it exploits heterogeneity in treatment effects for targeting individuals; (iii) it does not rely on the correct specification of a particular structural model; and (iv) it accommodates constraints on the policy function. An application for targeting information on social networks illustrates the advantages of the method.  ( 2 min )

We present an algorithm for learning mixtures of Markov chains and Markov decision processes (MDPs) from short unlabeled trajectories. Specifically, our method handles mixtures of Markov chains with optional control input by going through a multi-step process, involving (1) a subspace estimation step, (2) spectral clustering of trajectories using "pairwise distance estimators," along with refinement using the EM algorithm, (3) a model estimation step, and (4) a classification step for predicting labels of new trajectories. We provide end-to-end performance guarantees, where we only explicitly require the length of trajectories to be linear in the number of states and the number of trajectories to be linear in a mixing time parameter. Experimental results support these guarantees, where we attain 96.6% average accuracy on a mixture of two MDPs in gridworld, outperforming the EM algorithm with random initialization (73.2% average accuracy).  ( 2 min )

Detecting the presence of project management anti-patterns (AP) currently requires experts on the matter and is an expensive endeavor. Worse, experts may introduce their individual subjectivity or bias. Using the Fire Drill AP, we first introduce a novel way to translate descriptions into detectable AP that are comprised of arbitrary metrics and events such as logged time or maintenance activities, which are mined from the underlying source code or issue-tracking data, thus making the description objective as it becomes data-based. Secondly, we demonstrate a novel method to quantify and score the deviations of real-world projects to data-based AP descriptions. Using fifteen real-world projects that exhibit a Fire Drill to some degree, we show how to further enhance the translated AP. The ground truth in these projects was extracted from two individual experts and consensus was found between them. We introduce a novel method called automatic calibration, that optimizes a pattern such that only necessary and important scores remain that suffice to confidently detect the degree to which the AP is present. Without automatic calibration, the proposed patterns show only weak potential for detecting the presence. Enriching the AP with data from real-world projects significantly improves the potential. We also introduce a no-pattern approach that exploits the ground truth for establishing a new, quantitative understanding of the phenomenon, as well as for finding gray-/black-box predictive models. We conclude that the presence detection and severity assessment of the Fire Drill anti-pattern, as well as some of its related and similar patterns, is certainly possible using some of the presented approaches.  ( 3 min )

The manifold hypothesis, which assumes that data lies on or close to an unknown manifold of low intrinsic dimension, is a staple of modern machine learning research. However, recent work has shown that real-world data exhibits distinct non-manifold structures, i.e. singularities, that can lead to erroneous findings. Detecting such singularities is therefore crucial as a precursor to interpolation and inference tasks. We address this issue by developing a topological framework that (i) quantifies the local intrinsic dimension, and (ii) yields a Euclidicity score for assessing the 'manifoldness' of a point along multiple scales. Our approach identifies singularities of complex spaces, while also capturing singular structures and local geometric complexity in image data.  ( 2 min )

This manuscript proposes to extend the information set of time-series regression trees with latent stationary factors extracted via state-space methods. In doing so, this approach generalises time-series regression trees on two dimensions. First, it allows to handle predictors that exhibit measurement error, non-stationary trends, seasonality and/or irregularities such as missing observations. Second, it gives a transparent way for using domain-specific theory to inform time-series regression trees. As a byproduct, this technique sets the foundations for structuring powerful ensembles. Their real-world applicability is studied under the lenses of empirical macro-finance.  ( 2 min )

Developing machine learning-based interatomic potentials from ab-initio electronic structure methods remains a challenging task for computational chemistry and materials science. This work studies the capability of transfer learning, in particular discriminative fine-tuning, for efficiently generating chemically accurate interatomic neural network potentials on organic molecules from the MD17 and ANI data sets. We show that pre-training the network parameters on data obtained from density functional calculations considerably improves the sample efficiency of models trained on more accurate ab-initio data. Additionally, we show that fine-tuning with energy labels alone can suffice to obtain accurate atomic forces and run large-scale atomistic simulations, provided a well-designed fine-tuning data set. We also investigate possible limitations of transfer learning, especially regarding the design and size of the pre-training and fine-tuning data sets. Finally, we provide GM-NN potentials pre-trained and fine-tuned on the ANI-1x and ANI-1ccx data sets, which can easily be fine-tuned on and applied to organic molecules.  ( 2 min )

We study a variant of Newton's method for empirical risk minimization, where at each iteration of the optimization algorithm, we replace the gradient and Hessian of the objective function by robust estimators taken from existing literature on robust mean estimation for multivariate data. After proving a general theorem about the convergence of successive iterates to a small ball around the population-level minimizer, we study consequences of our theory in generalized linear models, when data are generated from Huber's epsilon-contamination model and/or heavy-tailed distributions. We also propose an algorithm for obtaining robust Newton directions based on the conjugate gradient method, which may be more appropriate for high-dimensional settings, and provide conjectures about the convergence of the resulting algorithm. Compared to the robust gradient descent algorithm proposed by Prasad et al. (2020), our algorithm enjoys the faster rates of convergence for successive iterates often achieved by second-order algorithms for convex problems, i.e., quadratic convergence in a neighborhood of the optimum, with a stepsize that may be chosen adaptively via backtracking linesearch.  ( 2 min )

Modern policy optimization methods in applied reinforcement learning are often inspired by the trust region policy optimization algorithm, which can be interpreted as a particular instance of policy mirror descent. While theoretical guarantees have been established for this framework, particularly in the tabular setting, the use of a general parametrization scheme remains mostly unjustified. In this work, we introduce a novel framework for policy optimization based on mirror descent that naturally accommodates general parametrizations. The policy class induced by our scheme recovers known classes, e.g. tabular softmax, log-linear, and neural policies. It also generates new ones, depending on the choice of the mirror map. For a general mirror map and parametrization function, we establish the quasi-monotonicity of the updates in value function, global linear convergence rates, and we bound the total variation of the algorithm along its path. To showcase the ability of our framework to accommodate general parametrization schemes, we present a case study involving shallow neural networks.  ( 2 min )

This paper builds bridges between two families of probabilistic algorithms: (hierarchical) variational inference (VI), which is typically used to model distributions over continuous spaces, and generative flow networks (GFlowNets), which have been used for distributions over discrete structures such as graphs. We demonstrate that, in certain cases, VI algorithms are equivalent to special cases of GFlowNets in the sense of equality of expected gradients of their learning objectives. We then point out the differences between the two families and show how these differences emerge experimentally. Notably, GFlowNets, which borrow ideas from reinforcement learning, are more amenable than VI to off-policy training without the cost of high gradient variance induced by importance sampling. We argue that this property of GFlowNets can provide advantages for capturing diversity in multimodal target distributions.  ( 2 min )

This article proposes a generalisation of the delete-$d$ jackknife to solve hyperparameter selection problems for time series. I call it artificial delete-$d$ jackknife to stress that this approach substitutes the classic removal step with a fictitious deletion, wherein observed datapoints are replaced with artificial missing values. This procedure keeps the data order intact and allows plain compatibility with time series. This manuscript justifies the use of this approach asymptotically and shows its finite-sample advantages through simulation studies. Besides, this article describes its real-world advantages by regulating high-dimensional forecasting models for foreign exchange rates.  ( 2 min )

As a regression technique in spatial statistics, the spatiotemporally varying coefficient model (STVC) is an important tool for discovering nonstationary and interpretable response-covariate associations over both space and time. However, it is difficult to apply STVC for large-scale spatiotemporal analyses due to its high computational cost. To address this challenge, we summarize the spatiotemporally varying coefficients using a third-order tensor structure and propose to reformulate the spatiotemporally varying coefficient model as a special low-rank tensor regression problem. The low-rank decomposition can effectively model the global patterns of the large data sets with a substantially reduced number of parameters. To further incorporate the local spatiotemporal dependencies, we use Gaussian process (GP) priors on the spatial and temporal factor matrices. We refer to the overall framework as Bayesian Kernelized Tensor Regression (BKTR). For model inference, we develop an efficient Markov chain Monte Carlo (MCMC) algorithm, which uses Gibbs sampling to update factor matrices and slice sampling to update kernel hyperparameters. We conduct extensive experiments on both synthetic and real-world data sets, and our results confirm the superior performance and efficiency of BKTR for model estimation and parameter inference.  ( 2 min )

We present a Gaussian Process (GP) approach (Gaussian Process Hydrodynamics, GPH) for approximating the solution of the Euler and Navier-Stokes equations. As in Smoothed Particle Hydrodynamics (SPH), GPH is a Lagrangian particle-based approach involving the tracking of a finite number of particles transported by the flow. However, these particles do not represent mollified particles of matter but carry discrete/partial information about the continuous flow. Closure is achieved by placing a divergence-free GP prior $\xi$ on the velocity field and conditioning on vorticity at particle locations. Known physics (e.g., the Richardson cascade and velocity-increments power laws) is incorporated into the GP prior through physics-informed additive kernels. This approach allows us to coarse-grain turbulence in a statistical manner rather than a deterministic one. By enforcing incompressibility and fluid/structure boundary conditions through the selection of the kernel, GPH requires much fewer particles than SPH. Since GPH has a natural probabilistic interpretation, numerical results come with uncertainty estimates enabling their incorporation into a UQ pipeline and the adding/removing of particles (quantas of information) in an adapted manner. The proposed approach is amenable to analysis, it inherits the complexity of state-of-the-art solvers for dense kernel matrices, and it leads to a natural definition of turbulence as information loss. Numerical experiments support the importance of selecting physics-informed kernels and illustrate the major impact of such kernels on accuracy and stability. Since the proposed approach has a Bayesian interpretation, it naturally enables data assimilation and making predictions and estimations based on mixing simulation data with experimental data.  ( 2 min )

Bayesian Neural Networks (BNNs) provide a tool to estimate the uncertainty of a neural network by considering a distribution over weights and sampling different models for each input. In this paper, we propose a method for uncertainty estimation in neural networks which, instead of considering a distribution over weights, samples outputs of each layer from a corresponding Gaussian distribution, parametrized by the predictions of mean and variance sub-layers. In uncertainty quality estimation experiments, we show that the proposed method achieves better uncertainty quality than other single-bin Bayesian Model Averaging methods, such as Monte Carlo Dropout or Bayes By Backpropagation methods.  ( 2 min )

In this paper, we study the bias of Stochastic Gradient Descent (SGD) to learn low-rank weight matrices when training deep ReLU neural networks. Our results show that training neural networks with mini-batch SGD and weight decay causes a bias towards rank minimization over the weight matrices. Specifically, we show, both theoretically and empirically, that this bias is more pronounced when using smaller batch sizes, higher learning rates, or increased weight decay. Additionally, we predict and observe empirically that weight decay is necessary to achieve this bias. Finally, we empirically investigate the connection between this bias and generalization, finding that it has a marginal effect on generalization. Our analysis is based on a minimal set of assumptions and applies to neural networks of any width or depth, including those with residual connections and convolutional layers.  ( 2 min )

Personalization of machine learning (ML) predictions for individual users/domains/enterprises is critical for practical recommendation style systems. Standard personalization approaches involve learning a user/domain specific embedding that is fed into a fixed global model which can be limiting. On the other hand, personalizing/fine-tuning model itself for each user/domain -- a.k.a meta-learning -- has high storage/infrastructure cost. We propose a novel meta-learning style approach that models network weights as a sum of low-rank and sparse matrices. This captures common information from multiple individuals/users together in the low-rank part while sparse part captures user-specific idiosyncrasies. Furthermore, the framework is up to two orders of magnitude more scalable (in terms of storage/infrastructure cost) than user-specific finetuning of model. We then study the framework in the linear setting, where the problem reduces to that of estimating the sum of a rank-$r$ and a $k$-column sparse matrix using a small number of linear measurements. We propose an alternating minimization method with iterative hard thresholding -- AMHT-LRS -- to learn the low-rank and sparse part. For the realizable, Gaussian data setting, we show that AMHT-LRS solves the problem efficiently with nearly optimal samples. A significant challenge in personalization is ensuring privacy of each user's sensitive data. We alleviate this problem by proposing a differentially private variant of our method that also is equipped with strong generalization guarantees. Finally, on multiple standard recommendation datasets, we demonstrate that our approach allows personalized models to obtain superior performance in sparse data regime.  ( 2 min )

We consider the problem of decision-making under uncertainty in an environment with safety constraints. Many business and industrial applications rely on real-time optimization to improve key performance indicators. In the case of unknown characteristics, real-time optimization becomes challenging, particularly because of the satisfaction of safety constraints. We propose the ARTEO algorithm, where we cast multi-armed bandits as a mathematical programming problem subject to safety constraints and learn the unknown characteristics through exploration while optimizing the targets. We quantify the uncertainty in unknown characteristics by using Gaussian processes and incorporate it into the cost function as a contribution which drives exploration. We adaptively control the size of this contribution in accordance with the requirements of the environment. We guarantee the safety of our algorithm with a high probability through confidence bounds constructed under the regularity assumptions of Gaussian processes. We demonstrate the safety and efficiency of our approach with two case studies: optimization of electric motor current and real-time bidding problems. We further evaluate the performance of ARTEO compared to a safe variant of upper confidence bound based algorithms. ARTEO achieves less cumulative regret with accurate and safe decisions.  ( 2 min )

We study high-probability regret bounds for adversarial $K$-armed bandits with time-varying feedback graphs over $T$ rounds. For general strongly observable graphs, we develop an algorithm that achieves the optimal regret $\widetilde{\mathcal{O}}((\sum_{t=1}^T\alpha_t)^{1/2}+\max_{t\in[T]}\alpha_t)$ with high probability, where $\alpha_t$ is the independence number of the feedback graph at round $t$. Compared to the best existing result [Neu, 2015] which only considers graphs with self-loops for all nodes, our result not only holds more generally, but importantly also removes any $\text{poly}(K)$ dependence that can be prohibitively large for applications such as contextual bandits. Furthermore, we also develop the first algorithm that achieves the optimal high-probability regret bound for weakly observable graphs, which even improves the best expected regret bound of [Alon et al., 2015] by removing the $\mathcal{O}(\sqrt{KT})$ term with a refined analysis. Our algorithms are based on the online mirror descent framework, but importantly with an innovative combination of several techniques. Notably, while earlier works use optimistic biased loss estimators for achieving high-probability bounds, we find it important to use a pessimistic one for nodes without self-loop in a strongly observable graph.  ( 2 min )

Efficient computation of the optimal transport distance between two distributions serves as an algorithm subroutine that empowers various applications. This paper develops a scalable first-order optimization-based method that computes optimal transport to within $\varepsilon$ additive accuracy with runtime $\widetilde{O}( n^2/\varepsilon)$, where $n$ denotes the dimension of the probability distributions of interest. Our algorithm achieves the state-of-the-art computational guarantees among all first-order methods, while exhibiting favorable numerical performance compared to classical algorithms like Sinkhorn and Greenkhorn. Underlying our algorithm designs are two key elements: (a) converting the original problem into a bilinear minimax problem over probability distributions; (b) exploiting the extragradient idea -- in conjunction with entropy regularization and adaptive learning rates -- to accelerate convergence.  ( 2 min )

We consider learning in an adversarial Markov Decision Process (MDP) where the loss functions can change arbitrarily over $K$ episodes and the state space can be arbitrarily large. We assume that the Q-function of any policy is linear in some known features, that is, a linear function approximation exists. The best existing regret upper bound for this setting (Luo et al., 2021) is of order $\tilde{\mathcal O}(K^{2/3})$ (omitting all other dependencies), given access to a simulator. This paper provides two algorithms that improve the regret to $\tilde{\mathcal O}(\sqrt K)$ in the same setting. Our first algorithm makes use of a refined analysis of the Follow-the-Regularized-Leader (FTRL) algorithm with the log-barrier regularizer. This analysis allows the loss estimators to be arbitrarily negative and might be of independent interest. Our second algorithm develops a magnitude-reduced loss estimator, further removing the polynomial dependency on the number of actions in the first algorithm and leading to the optimal regret bound (up to logarithmic terms and dependency on the horizon). Moreover, we also extend the first algorithm to simulator-free linear MDPs, which achieves $\tilde{\mathcal O}(K^{8/9})$ regret and greatly improves over the best existing bound $\tilde{\mathcal O}(K^{14/15})$. This algorithm relies on a better alternative to the Matrix Geometric Resampling procedure by Neu & Olkhovskaya (2020), which could again be of independent interest.  ( 2 min )

With the growing competition in banking industry, banks are required to follow customer retention strategies while they are trying to increase their market share by acquiring new customers. This study compares the performance of six supervised classification techniques to suggest an efficient model to predict customer churn in banking industry, given 10 demographic and personal attributes from 10000 customers of European banks. The effect of feature selection, class imbalance, and outliers will be discussed for ANN and random forest as the two competing models. As shown, unlike random forest, ANN does not reveal any serious concern regarding overfitting and is also robust to noise. Therefore, ANN structure with five nodes in a single hidden layer is recognized as the best performing classifier.  ( 2 min )

This work presents mixed variational flows (MixFlows), a new variational family that consists of a mixture of repeated applications of a map to an initial reference distribution. First, we provide efficient algorithms for i.i.d. sampling, density evaluation, and unbiased ELBO estimation. We then show that MixFlows have MCMC-like convergence guarantees when the flow map is ergodic and measure-preserving, and provide bounds on the accumulation of error for practical implementations where the flow map is approximated. Finally, we develop an implementation of MixFlows based on uncorrected discretized Hamiltonian dynamics combined with deterministic momentum refreshment. Simulated and real data experiments show that MixFlows can provide more reliable posterior approximations than several black-box normalizing flows, as well as samples of comparable quality to those obtained from state-of-the-art MCMC methods.  ( 2 min )

This paper introduces a new simulation-based inference procedure to model and sample from multi-dimensional probability distributions given access to i.i.d.\ samples, circumventing the usual approaches of explicitly modeling the density function or designing Markov chain Monte Carlo. Motivated by the seminal work on distance and isomorphism between metric measure spaces, we propose a new notion called the Reversible Gromov-Monge (RGM) distance and study how RGM can be used to design new transform samplers to perform simulation-based inference. Our RGM sampler can also estimate optimal alignments between two heterogeneous metric measure spaces $(\cX, \mu, c_{\cX})$ and $(\cY, \nu, c_{\cY})$ from empirical data sets, with estimated maps that approximately push forward one measure $\mu$ to the other $\nu$, and vice versa. We study the analytic properties of the RGM distance and derive that under mild conditions, RGM equals the classic Gromov-Wasserstein distance. Curiously, drawing a connection to Brenier's polar factorization, we show that the RGM sampler induces bias towards strong isomorphism with proper choices of $c_{\cX}$ and $c_{\cY}$. Statistical rate of convergence, representation, and optimization questions regarding the induced sampler are studied. Synthetic and real-world examples showcasing the effectiveness of the RGM sampler are also demonstrated.  ( 2 min )

With model trustworthiness being crucial for sensitive real-world applications, practitioners are putting more and more focus on improving the uncertainty calibration of deep neural networks. Calibration errors are designed to quantify the reliability of probabilistic predictions but their estimators are usually biased and inconsistent. In this work, we introduce the framework of proper calibration errors, which relates every calibration error to a proper score and provides a respective upper bound with optimal estimation properties. This relationship can be used to reliably quantify the model calibration improvement. We theoretically and empirically demonstrate the shortcomings of commonly used estimators compared to our approach. Due to the wide applicability of proper scores, this gives a natural extension of recalibration beyond classification.  ( 2 min )

Support vector machines (SVM) and other kernel techniques represent a family of powerful statistical classification methods with high accuracy and broad applicability. Because they use all or a significant portion of the training data, however, they can be slow, especially for large problems. Piecewise linear classifiers are similarly versatile, yet have the additional advantages of simplicity, ease of interpretation and, if the number of component linear classifiers is not too large, speed. Here we show how a simple, piecewise linear classifier can be trained from a kernel-based classifier in order to improve the classification speed. The method works by finding the root of the difference in conditional probabilities between pairs of opposite classes to build up a representation of the decision boundary. When tested on 17 different datasets, it succeeded in improving the classification speed of a SVM for 12 of them by up to two orders-of-magnitude. Of these, two were less accurate than a simple, linear classifier. The method is best suited to problems with continuum features data and smooth probability functions. Because the component linear classifiers are built up individually from an existing classifier, rather than through a simultaneous optimization procedure, the classifier is also fast to train.  ( 2 min )

Gaussian processes are arguably the most important class of spatiotemporal models within machine learning. They encode prior information about the modeled function and can be used for exact or approximate Bayesian learning. In many applications, particularly in physical sciences and engineering, but also in areas such as geostatistics and neuroscience, invariance to symmetries is one of the most fundamental forms of prior information one can consider. The invariance of a Gaussian process' covariance to such symmetries gives rise to the most natural generalization of the concept of stationarity to such spaces. In this work, we develop constructive and practical techniques for building stationary Gaussian processes on a very large class of non-Euclidean spaces arising in the context of symmetries. Our techniques make it possible to (i) calculate covariance kernels and (ii) sample from prior and posterior Gaussian processes defined on such spaces, both in a practical manner. This work is split into two parts, each involving different technical considerations: part I studies compact spaces, while part II studies non-compact spaces possessing certain structure. Our contributions make the non-Euclidean Gaussian process models we study compatible with well-understood computational techniques available in standard Gaussian process software packages, thereby making them accessible to practitioners.  ( 2 min )

Reinforcement learning, mathematically described by Markov Decision Problems, may be approached either through dynamic programming or policy search. Actor-critic algorithms combine the merits of both approaches by alternating between steps to estimate the value function and policy gradient updates. Due to the fact that the updates exhibit correlated noise and biased gradient updates, only the asymptotic behavior of actor-critic is known by connecting its behavior to dynamical systems. This work puts forth a new variant of actor-critic that employs Monte Carlo rollouts during the policy search updates, which results in controllable bias that depends on the number of critic evaluations. As a result, we are able to provide for the first time the convergence rate of actor-critic algorithms when the policy search step employs policy gradient, agnostic to the choice of policy evaluation technique. In particular, we establish conditions under which the sample complexity is comparable to stochastic gradient method for non-convex problems or slower as a result of the critic estimation error, which is the main complexity bottleneck. These results hold in continuous state and action spaces with linear function approximation for the value function. We then specialize these conceptual results to the case where the critic is estimated by Temporal Difference, Gradient Temporal Difference, and Accelerated Gradient Temporal Difference. These learning rates are then corroborated on a navigation problem involving an obstacle and the pendulum problem which provide insight into the interplay between optimization and generalization in reinforcement learning.  ( 2 min )

Performance benchmarking is a crucial component of time series classification (TSC) algorithm design, and a fast-growing number of datasets have been established for empirical benchmarking. However, the empirical benchmarks are costly and do not guarantee statistical optimality. This study proposes to benchmark the optimality of TSC algorithms in distinguishing diffusion processes by the likelihood ratio test (LRT). The LRT is optimal in the sense of the Neyman-Pearson lemma: it has the smallest false positive rate among classifiers with a controlled level of false negative rate. The LRT requires the likelihood ratio of the time series to be computable. The diffusion processes from stochastic differential equations provide such time series and are flexible in design for generating linear or nonlinear time series. We demonstrate the benchmarking with three scalable state-of-the-art TSC algorithms: random forest, ResNet, and ROCKET. Test results show that they can achieve LRT optimality for univariate time series and multivariate Gaussian processes. However, these model-agnostic algorithms are suboptimal in classifying nonlinear multivariate time series from high-dimensional stochastic interacting particle systems. Additionally, the LRT benchmark provides tools to analyze the dependence of classification accuracy on the time length, dimension, temporal sampling frequency, and randomness of the time series. Thus, the LRT with diffusion processes can systematically and efficiently benchmark the optimality of TSC algorithms and may guide their future improvements.  ( 2 min )

Graph Neural Networks (GNNs) had been demonstrated to be inherently susceptible to the problems of over-smoothing and over-squashing. These issues prohibit the ability of GNNs to model complex graph interactions by limiting their effectiveness in taking into account distant information. Our study reveals the key connection between the local graph geometry and the occurrence of both of these issues, thereby providing a unified framework for studying them at a local scale using the Ollivier-Ricci curvature. Specifically, we demonstrate that over-smoothing is linked to positive graph curvature, while over-squashing is linked to negative graph curvature. Based on our theory, we propose the Batch Ollivier-Ricci Flow, a novel rewiring algorithm capable of simultaneously addressing both over-smoothing and over-squashing.  ( 2 min )

There are many recent research efforts to fine-tune a pre-trained generator with a few target images to generate images of a novel domain. Unfortunately, these methods often suffer from overfitting or under-fitting when fine-tuned with a single target image. To address this, here we present a novel single-shot GAN adaptation method through unified CLIP space manipulations. Specifically, our model employs a two-step training strategy: reference image search in the source generator using a CLIP-guided latent optimization, followed by generator fine-tuning with a novel loss function that imposes CLIP space consistency between the source and adapted generators. To further improve the adapted model to produce spatially consistent samples with respect to the source generator, we also propose contrastive regularization for patchwise relationships in the CLIP space. Experimental results show that our model generates diverse outputs with the target texture and outperforms the baseline models both qualitatively and quantitatively. Furthermore, we show that our CLIP space manipulation strategy allows more effective attribute editing.  ( 2 min )

Knowledge distillation has been widely-used to improve the performance of a "student" network by hoping to mimic soft probabilities of a "teacher" network. Yet, for self-distillation to work, the student must somehow deviate from the teacher (Stanton et al., 2021). But what is the nature of these deviations, and how do they relate to gains in generalization? We investigate these questions through a series of experiments across image and language classification datasets. First, we observe that distillation consistently deviates in a characteristic way: on points where the teacher has low confidence, the student achieves even lower confidence than the teacher. Secondly, we find that deviations in the initial dynamics of training are not crucial -- simply switching to distillation loss in the middle of training can recover much of its gains. We then provide two parallel theoretical perspectives to understand the role of student-teacher deviations in our experiments, one casting distillation as a regularizer in eigenspace, and another as a gradient denoiser. Our analysis bridges several gaps between existing theory and practice by (a) focusing on gradient-descent training, (b) by avoiding label noise assumptions, and (c) by unifying several disjoint empirical and theoretical findings.  ( 2 min )

Location-scale noise models (LSNMs) are a class of heteroscedastic structural causal models with wide applicability, closely related to affine flow models. Recent likelihood-based methods designed for LSNMs that infer cause-effect relationships achieve state-of-the-art accuracy, when their assumptions are satisfied concerning the noise distributions. However, under misspecification their accuracy deteriorates sharply, especially when the conditional variance in the anti-causal direction is smaller than that in the causal direction. In this paper, we demonstrate the misspecification problem and analyze why and when it occurs. We show that residual independence testing is much more robust to misspecification than likelihood-based cause-effect inference. Our empirical evaluation includes 580 synthetic and 99 real-world datasets.  ( 2 min )

Graph generative model evaluation necessitates understanding differences between graphs on the distributional level. This entails being able to harness salient attributes of graphs in an efficient manner. Curvature constitutes one such property of graphs, and has recently started to prove useful in characterising graphs. Its expressive properties, stability, and practical utility in model evaluation remain largely unexplored, however. We combine graph curvature descriptors with cutting-edge methods from topological data analysis to obtain robust, expressive descriptors for evaluating graph generative models.  ( 2 min )

Heteroscedastic classifiers, which learn a multivariate Gaussian distribution over prediction logits, have been shown to perform well on image classification problems with hundreds to thousands of classes. However, compared to standard classifiers, they introduce extra parameters that scale linearly with the number of classes. This makes them infeasible to apply to larger-scale problems. In addition heteroscedastic classifiers introduce a critical temperature hyperparameter which must be tuned. We propose HET-XL, a heteroscedastic classifier whose parameter count when compared to a standard classifier scales independently of the number of classes. In our large-scale settings, we show that we can remove the need to tune the temperature hyperparameter, by directly learning it on the training data. On large image classification datasets with up to 4B images and 30k classes our method requires 14X fewer additional parameters, does not require tuning the temperature on a held-out set and performs consistently better than the baseline heteroscedastic classifier. HET-XL improves ImageNet 0-shot classification in a multimodal contrastive learning setup which can be viewed as a 3.5 billion class classification problem.  ( 2 min )

We investigate the expressive power of depth-2 bandlimited random neural networks. A random net is a neural network where the hidden layer parameters are frozen with random assignment, and only the output layer parameters are trained by loss minimization. Using random weights for a hidden layer is an effective method to avoid non-convex optimization in standard gradient descent learning. It has also been adopted in recent deep learning theories. Despite the well-known fact that a neural network is a universal approximator, in this study, we mathematically show that when hidden parameters are distributed in a bounded domain, the network may not achieve zero approximation error. In particular, we derive a new nontrivial approximation error lower bound. The proof utilizes the technique of ridgelet analysis, a harmonic analysis method designed for neural networks. This method is inspired by fundamental principles in classical signal processing, specifically the idea that signals with limited bandwidth may not always be able to perfectly recreate the original signal. We corroborate our theoretical results with various simulation studies, and generally, two main take-home messages are offered: (i) Not any distribution for selecting random weights is feasible to build a universal approximator; (ii) A suitable assignment of random weights exists but to some degree is associated with the complexity of the target function.  ( 2 min )

To address the bias exhibited by machine learning models, fairness criteria impose statistical constraints for ensuring equal treatment to all demographic groups, but typically at a cost to model performance. Understanding this tradeoff, therefore, underlies the design of fair and effective algorithms. This paper completes the characterization of the inherent tradeoff of demographic parity on classification problems in the most general multigroup, multiclass, and noisy setting. Specifically, we show that the minimum error rate is given by the optimal value of a Wasserstein-barycenter problem. More practically, this reformulation leads to a simple procedure for post-processing any pre-trained predictors to satisfy demographic parity in the general setting, which, in particular, yields the optimal fair classifier when applied to the Bayes predictor. We provide suboptimality and finite sample analyses for our procedure, and demonstrate precise control of the tradeoff of error rate for fairness on real-world datasets provided sufficient data.  ( 2 min )

We study reinforcement learning with linear function approximation and adversarially changing cost functions, a setup that has mostly been considered under simplifying assumptions such as full information feedback or exploratory conditions.We present a computationally efficient policy optimization algorithm for the challenging general setting of unknown dynamics and bandit feedback, featuring a combination of mirror-descent and least squares policy evaluation in an auxiliary MDP used to compute exploration bonuses.Our algorithm obtains an $\widetilde O(K^{6/7})$ regret bound, improving significantly over previous state-of-the-art of $\widetilde O (K^{14/15})$ in this setting. In addition, we present a version of the same algorithm under the assumption a simulator of the environment is available to the learner (but otherwise no exploratory assumptions are made), and prove it obtains state-of-the-art regret of $\widetilde O (K^{2/3})$.  ( 2 min )

Personalized medicine, a paradigm of medicine tailored to a patient's characteristics, is an increasingly attractive field in health care. An important goal of personalized medicine is to identify a subgroup of patients, based on baseline covariates, that benefits more from the targeted treatment than other comparative treatments. Most of the current subgroup identification methods only focus on obtaining a subgroup with an enhanced treatment effect without paying attention to subgroup size. Yet, a clinically meaningful subgroup learning approach should identify the maximum number of patients who can benefit from the better treatment. In this paper, we present an optimal subgroup selection rule (SSR) that maximizes the number of selected patients, and in the meantime, achieves the pre-specified clinically meaningful mean outcome, such as the average treatment effect. We derive two equivalent theoretical forms of the optimal SSR based on the contrast function that describes the treatment-covariates interaction in the outcome. We further propose a ConstrAined PolIcy Tree seArch aLgorithm (CAPITAL) to find the optimal SSR within the interpretable decision tree class. The proposed method is flexible to handle multiple constraints that penalize the inclusion of patients with negative treatment effects, and to address time to event data using the restricted mean survival time as the clinically interesting mean outcome. Extensive simulations, comparison studies, and real data applications are conducted to demonstrate the validity and utility of our method.  ( 2 min )

Domain generalization (DG) seeks predictors which perform well on unseen test distributions by leveraging data drawn from multiple related training distributions or domains. To achieve this, DG is commonly formulated as an average- or worst-case problem over the set of possible domains. However, predictors that perform well on average lack robustness while predictors that perform well in the worst case tend to be overly-conservative. To address this, we propose a new probabilistic framework for DG where the goal is to learn predictors that perform well with high probability. Our key idea is that distribution shifts seen during training should inform us of probable shifts at test time, which we realize by explicitly relating training and test domains as draws from the same underlying meta-distribution. To achieve probable DG, we propose a new optimization problem called Quantile Risk Minimization (QRM). By minimizing the $\alpha$-quantile of predictor's risk distribution over domains, QRM seeks predictors that perform well with probability $\alpha$. To solve QRM in practice, we propose the Empirical QRM (EQRM) algorithm and provide: (i) a generalization bound for EQRM; and (ii) the conditions under which EQRM recovers the causal predictor as $\alpha \to 1$. In our experiments, we introduce a more holistic quantile-focused evaluation protocol for DG and demonstrate that EQRM outperforms state-of-the-art baselines on datasets from WILDS and DomainBed.  ( 2 min )

Many areas of science make extensive use of computer simulators that implicitly encode likelihood functions of complex systems. Classical statistical methods are poorly suited for these so-called likelihood-free inference (LFI) settings, particularly outside asymptotic and low-dimensional regimes. Although new machine learning methods, such as normalizing flows, have revolutionized the sample efficiency and capacity of LFI methods, it remains an open question whether they produce confidence sets with correct conditional coverage for small sample sizes. This paper unifies classical statistics with modern machine learning to present (i) a practical procedure for the Neyman construction of confidence sets with finite-sample guarantees of nominal coverage, and (ii) diagnostics that estimate conditional coverage over the entire parameter space. We refer to our framework as likelihood-free frequentist inference (LF2I). Any method that defines a test statistic, like the likelihood ratio, can leverage the LF2I machinery to create valid confidence sets and diagnostics without costly Monte Carlo samples at fixed parameter settings. We study the power of two test statistics (ACORE and BFF), which, respectively, maximize versus integrate an odds function over the parameter space. Our paper discusses the benefits and challenges of LF2I, with a breakdown of the sources of errors in LF2I confidence sets.  ( 2 min )

Recent work on mini-batch consistency (MBC) for set functions has brought attention to the need for sequentially processing and aggregating chunks of a partitioned set while guaranteeing the same output for all partitions. However, existing constraints on MBC architectures lead to models with limited expressive power. Additionally, prior work has not addressed how to deal with large sets during training when the full set gradient is required. To address these issues, we propose a Universally MBC (UMBC) class of set functions which can be used in conjunction with arbitrary non-MBC components while still satisfying MBC, enabling a wider range of function classes to be used in MBC settings. Furthermore, we propose an efficient MBC training algorithm which gives an unbiased approximation of the full set gradient and has a constant memory overhead for any set size for both train- and test-time. We conduct extensive experiments including image completion, text classification, unsupervised clustering, and cancer detection on high-resolution images to verify the efficiency and efficacy of our scalable set encoding framework.  ( 2 min )

Solving high-dimensional partial differential equations is a recurrent challenge in economics, science and engineering. In recent years, a great number of computational approaches have been developed, most of them relying on a combination of Monte Carlo sampling and deep learning based approximation. For elliptic and parabolic problems, existing methods can broadly be classified into those resting on reformulations in terms of $\textit{backward stochastic differential equations}$ (BSDEs) and those aiming to minimize a regression-type $L^2$-error ($\textit{physics-informed neural networks}$, PINNs). In this paper, we review the literature and suggest a methodology based on the novel $\textit{diffusion loss}$ that interpolates between BSDEs and PINNs. Our contribution opens the door towards a unified understanding of numerical approaches for high-dimensional PDEs, as well as for implementations that combine the strengths of BSDEs and PINNs. The diffusion loss furthermore bears close similarities to $\textit{(least squares) temporal difference}$ objectives found in reinforcement learning. We also discuss eigenvalue problems and perform extensive numerical studies, including calculations of the ground state for nonlinear Schr\"odinger operators and committor functions relevant in molecular dynamics.  ( 2 min )

Generative flow networks (GFlowNets) are amortized variational inference algorithms that are trained to sample from unnormalized target distributions over compositional objects. A key limitation of GFlowNets until this time has been that they are restricted to discrete spaces. We present a theory for generalized GFlowNets, which encompasses both existing discrete GFlowNets and ones with continuous or hybrid state spaces, and perform experiments with two goals in mind. First, we illustrate critical points of the theory and the importance of various assumptions. Second, we empirically demonstrate how observations about discrete GFlowNets transfer to the continuous case and show strong results compared to non-GFlowNet baselines on several previously studied tasks. This work greatly widens the perspectives for the application of GFlowNets in probabilistic inference and various modeling settings.  ( 2 min )

Motivated by the success of Bayesian optimisation algorithms in the Euclidean space, we propose a novel approach to construct Intrinsic Bayesian optimisation (In-BO) on manifolds with a primary focus on complex constrained domains or irregular-shaped spaces arising as submanifolds of R2, R3 and beyond. Data may be collected in a spatial domain but restricted to a complex or intricately structured region corresponding to a geographic feature, such as lakes. Traditional Bayesian Optimisation (Tra-BO) defined with a Radial basis function (RBF) kernel cannot accommodate these complex constrained conditions. The In-BO uses the Sparse Intrinsic Gaussian Processes (SIn-GP) surrogate model to take into account the geometric structure of the manifold. SInGPs are constructed using the heat kernel of the manifold which is estimated as the transition density of the Brownian Motion on manifolds. The efficiency of In-BO is demonstrated through simulation studies on a U-shaped domain, a Bitten torus, and a real dataset from the Aral sea. Its performance is compared to that of traditional BO, which is defined in Euclidean space.  ( 2 min )

Learning decompositions of expensive-to-evaluate black-box functions promises to scale Bayesian optimisation (BO) to high-dimensional problems. However, the success of these techniques depends on finding proper decompositions that accurately represent the black-box. While previous works learn those decompositions based on data, we investigate data-independent decomposition sampling rules in this paper. We find that data-driven learners of decompositions can be easily misled towards local decompositions that do not hold globally across the search space. Then, we formally show that a random tree-based decomposition sampler exhibits favourable theoretical guarantees that effectively trade off maximal information gain and functional mismatch between the actual black-box and its surrogate as provided by the decomposition. Those results motivate the development of the random decomposition upper-confidence bound algorithm (RDUCB) that is straightforward to implement - (almost) plug-and-play - and, surprisingly, yields significant empirical gains compared to the previous state-of-the-art on a comprehensive set of benchmarks. We also confirm the plug-and-play nature of our modelling component by integrating our method with HEBO, showing improved practical gains in the highest dimensional tasks from Bayesmark.  ( 2 min )

Actor-critic algorithms address the dual goals of reinforcement learning, policy evaluation and improvement, via two separate function approximators. The practicality of this approach comes at the expense of training instability, caused mainly by the destructive effect of the approximation errors of the critic on the actor. We tackle this bottleneck by employing an existing Probably Approximately Correct (PAC) Bayesian bound for the first time as the critic training objective of the Soft Actor-Critic (SAC) algorithm. We further demonstrate that the online learning performance improves significantly when a stochastic actor explores multiple futures by critic-guided random search. We observe our resulting algorithm to compare favorably to the state of the art on multiple classical control and locomotion tasks in both sample efficiency and asymptotic performance.  ( 2 min )

Bagging is an important technique for stabilizing machine learning models. In this paper, we derive a finite-sample guarantee on the stability of bagging for any model with bounded outputs. Our result places no assumptions on the distribution of the data, on the properties of the base algorithm, or on the dimensionality of the covariates. Our guarantee applies to many variants of bagging and is optimal up to a constant.  ( 2 min )

We consider the problem of mixed linear regression (MLR), where each observed sample belongs to one of $K$ unknown linear models. In practical applications, the proportions of the $K$ components are often imbalanced. Unfortunately, most MLR methods do not perform well in such settings. Motivated by this practical challenge, in this work we propose Mix-IRLS, a novel, simple and fast algorithm for MLR with excellent performance on both balanced and imbalanced mixtures. In contrast to popular approaches that recover the $K$ models simultaneously, Mix-IRLS does it sequentially using tools from robust regression. Empirically, Mix-IRLS succeeds in a broad range of settings where other methods fail. These include imbalanced mixtures, small sample sizes, presence of outliers, and an unknown number of models $K$. In addition, Mix-IRLS outperforms competing methods on several real-world datasets, in some cases by a large margin. We complement our empirical results by deriving a recovery guarantee for Mix-IRLS, which highlights its advantage on imbalanced mixtures.  ( 2 min )

A compression function is a map that slims down an observational set into a subset of reduced size, while preserving its informational content. In multiple applications, the condition that one new observation makes the compressed set change is interpreted that this observation brings in extra information and, in learning theory, this corresponds to misclassification, or misprediction. In this paper, we lay the foundations of a new theory that allows one to keep control on the probability of change of compression (called the "risk"). We identify conditions under which the cardinality of the compressed set is a consistent estimator for the risk (without any upper limit on the size of the compressed set) and prove unprecedentedly tight bounds to evaluate the risk under a generally applicable condition of preference. All results are usable in a fully agnostic setup, without requiring any a priori knowledge on the probability distribution of the observations. Not only these results offer a valid support to develop trust in observation-driven methodologies, they also play a fundamental role in learning techniques as a tool for hyper-parameter tuning.  ( 2 min )

It is well known that accurate probabilistic predictors can be trained through empirical risk minimisation with proper scoring rules as loss functions. While such learners capture so-called aleatoric uncertainty of predictions, various machine learning methods have recently been developed with the goal to let the learner also represent its epistemic uncertainty, i.e., the uncertainty caused by a lack of knowledge and data. An emerging branch of the literature proposes the use of a second-order learner that provides predictions in terms of distributions on probability distributions. However, recent work has revealed serious theoretical shortcomings for second-order predictors based on loss minimisation. In this paper, we generalise these findings and prove a more fundamental result: There seems to be no loss function that provides an incentive for a second-order learner to faithfully represent its epistemic uncertainty in the same manner as proper scoring rules do for standard (first-order) learners. As a main mathematical tool to prove this result, we introduce the generalised notion of second-order scoring rules.  ( 2 min )

High-cardinality categorical features are pervasive in actuarial data (e.g. occupation in commercial property insurance). Standard categorical encoding methods like one-hot encoding are inadequate in these settings. In this work, we present a novel _Generalised Linear Mixed Model Neural Network_ ("GLMMNet") approach to the modelling of high-cardinality categorical features. The GLMMNet integrates a generalised linear mixed model in a deep learning framework, offering the predictive power of neural networks and the transparency of random effects estimates, the latter of which cannot be obtained from the entity embedding models. Further, its flexibility to deal with any distribution in the exponential dispersion (ED) family makes it widely applicable to many actuarial contexts and beyond. We illustrate and compare the GLMMNet against existing approaches in a range of simulation experiments as well as in a real-life insurance case study. Notably, we find that the GLMMNet often outperforms or at least performs comparably with an entity embedded neural network, while providing the additional benefit of transparency, which is particularly valuable in practical applications. Importantly, while our model was motivated by actuarial applications, it can have wider applicability. The GLMMNet would suit any applications that involve high-cardinality categorical variables and where the response cannot be sufficiently modelled by a Gaussian distribution.  ( 2 min )

In $\mathbb R^d$, it is well-known that cumulants provide an alternative to moments that can achieve the same goals with numerous benefits such as lower variance estimators. In this paper we extend cumulants to reproducing kernel Hilbert spaces (RKHS) using tools from tensor algebras and show that they are computationally tractable by a kernel trick. These kernelized cumulants provide a new set of all-purpose statistics; the classical maximum mean discrepancy and Hilbert-Schmidt independence criterion arise as the degree one objects in our general construction. We argue both theoretically and empirically (on synthetic, environmental, and traffic data analysis) that going beyond degree one has several advantages and can be achieved with the same computational complexity and minimal overhead in our experiments.  ( 2 min )

We study the implicit regularization of gradient descent towards structured sparsity via a novel neural reparameterization, which we call a diagonally grouped linear neural network. We show the following intriguing property of our reparameterization: gradient descent over the squared regression loss, without any explicit regularization, biases towards solutions with a group sparsity structure. In contrast to many existing works in understanding implicit regularization, we prove that our training trajectory cannot be simulated by mirror descent. We analyze the gradient dynamics of the corresponding regression problem in the general noise setting and obtain minimax-optimal error rates. Compared to existing bounds for implicit sparse regularization using diagonal linear networks, our analysis with the new reparameterization shows improved sample complexity. In the degenerate case of size-one groups, our approach gives rise to a new algorithm for sparse linear regression. Finally, we demonstrate the efficacy of our approach with several numerical experiments.  ( 2 min )

We explore the problem of generating minority samples using diffusion models. The minority samples are instances that lie on low-density regions of a data manifold. Generating sufficient numbers of such minority instances is important, since they often contain some unique attributes of the data. However, the conventional generation process of the diffusion models mostly yields majority samples (that lie on high-density regions of the manifold) due to their high likelihoods, making themselves highly ineffective and time-consuming for the task. In this work, we present a novel framework that can make the generation process of the diffusion models focus on the minority samples. We first provide a new insight on the majority-focused nature of the diffusion models: they denoise in favor of the majority samples. The observation motivates us to introduce a metric that describes the uniqueness of a given sample. To address the inherent preference of the diffusion models w.r.t. the majority samples, we further develop minority guidance, a sampling technique that can guide the generation process toward regions with desired likelihood levels. Experiments on benchmark real datasets demonstrate that our minority guidance can greatly improve the capability of generating the low-likelihood minority samples over existing generative frameworks including the standard diffusion sampler.  ( 2 min )

This paper studies the expressive power of deep neural networks from the perspective of function compositions. We show that repeated compositions of a single fixed-size ReLU network can produce super expressive power. In particular, we prove by construction that $\mathcal{L}_2\circ \boldsymbol{g}^{\circ r}\circ \boldsymbol{\mathcal{L}}_1$ can approximate $1$-Lipschitz continuous functions on $[0,1]^d$ with an error $\mathcal{O}(r^{-1/d})$, where $\boldsymbol{g}$ is realized by a fixed-size ReLU network, $\boldsymbol{\mathcal{L}}_1$ and $\mathcal{L}_2$ are two affine linear maps matching the dimensions, and $\boldsymbol{g}^{\circ r}$ means the $r$-times composition of $\boldsymbol{g}$. Furthermore, we extend such a result to generic continuous functions on $[0,1]^d$ with the approximation error characterized by the modulus of continuity. Our results reveal that a continuous-depth network generated via a dynamical system has good approximation power even if its dynamics function is time-independent and realized by a fixed-size ReLU network.  ( 2 min )

LiDAR (Light Detection and Ranging) is an advanced active remote sensing technique working on the principle of time of travel (ToT) for capturing highly accurate 3D information of the surroundings. LiDAR has gained wide attention in research and development with the LiDAR industry expected to reach 2.8 billion $ by 2025. Although the LiDAR dataset is of rich density and high spatial resolution, it is challenging to process LiDAR data due to its inherent 3D geometry and massive volume. But such a high-resolution dataset possesses immense potential in many applications and has great potential in 3D object detection and recognition. In this research we propose Graph Neural Network (GNN) based framework to learn and identify the objects in the 3D LiDAR point clouds. GNNs are class of deep learning which learns the patterns and objects based on the principle of graph learning which have shown success in various 3D computer vision tasks.  ( 2 min )

In this paper, we study the problem of optimal data collection for policy evaluation in linear bandits. In policy evaluation, we are given a target policy and asked to estimate the expected cumulative reward it will obtain when executed in an environment formalized as a multi-armed bandit. In this paper, we focus on linear bandit setting with heteroscedastic reward noise. This is the first work that focuses on such an optimal data collection strategy for policy evaluation involving heteroscedastic reward noise in the linear bandit setting. We first formulate an optimal design for weighted least squares estimates in the heteroscedastic linear bandit setting that reduces the MSE of the target policy. We term this as policy-weighted least square estimation and use this formulation to derive the optimal behavior policy for data collection. We then propose a novel algorithm SPEED (Structured Policy Evaluation Experimental Design) that tracks the optimal behavior policy and derive its regret with respect to the optimal behavior policy. Finally, we empirically validate that SPEED leads to policy evaluation with mean squared error comparable to the oracle strategy and significantly lower than simply running the target policy.  ( 2 min )

Heterogeneity and comorbidity are two interwoven challenges associated with various healthcare problems that greatly hampered research on developing effective treatment and understanding of the underlying neurobiological mechanism. Very few studies have been conducted to investigate heterogeneous causal effects (HCEs) in graphical contexts due to the lack of statistical methods. To characterize this heterogeneity, we first conceptualize heterogeneous causal graphs (HCGs) by generalizing the causal graphical model with confounder-based interactions and multiple mediators. Such confounders with an interaction with the treatment are known as moderators. This allows us to flexibly produce HCGs given different moderators and explicitly characterize HCEs from the treatment or potential mediators on the outcome. We establish the theoretical forms of HCEs and derive their properties at the individual level in both linear and nonlinear models. An interactive structural learning is developed to estimate the complex HCGs and HCEs with confidence intervals provided. Our method is empirically justified by extensive simulations and its practical usefulness is illustrated by exploring causality among psychiatric disorders for trauma survivors.  ( 2 min )

The causal revolution has spurred interest in understanding complex relationships in various fields. Most existing methods aim to discover causal relationships among all variables in a large-scale complex graph. However, in practice, only a small number of variables in the graph are relevant for the outcomes of interest. As a result, causal estimation with the full causal graph -- especially given limited data -- could lead to many falsely discovered, spurious variables that may be highly correlated with but have no causal impact on the target outcome. In this paper, we propose to learn a class of necessary and sufficient causal graphs (NSCG) that only contains causally relevant variables for an outcome of interest, which we term causal features. The key idea is to utilize probabilities of causation to systematically evaluate the importance of features in the causal graph, allowing us to identify a subgraph that is relevant to the outcome of interest. To learn NSCG from data, we develop a score-based necessary and sufficient causal structural learning (NSCSL) algorithm, by establishing theoretical relationships between probabilities of causation and causal effects of features. Across empirical studies of simulated and real data, we show that the proposed NSCSL algorithm outperforms existing algorithms and can reveal important yeast genes for target heritable traits of interest.  ( 2 min )

We propose a novel, fully nonparametric approach for the multi-task learning, the Multi-task Highly Adaptive Lasso (MT-HAL). MT-HAL simultaneously learns features, samples and task associations important for the common model, while imposing a shared sparse structure among similar tasks. Given multiple tasks, our approach automatically finds a sparse sharing structure. The proposed MTL algorithm attains a powerful dimension-free convergence rate of $o_p(n^{-1/4})$ or better. We show that MT-HAL outperforms sparsity-based MTL competitors across a wide range of simulation studies, including settings with nonlinear and linear relationships, varying levels of sparsity and task correlations, and different numbers of covariates and sample size.  ( 2 min )

Model-based methods have recently shown great potential for off-policy evaluation (OPE); offline trajectories induced by behavioral policies are fitted to transitions of Markov decision processes (MDPs), which are used to rollout simulated trajectories and estimate the performance of policies. Model-based OPE methods face two key challenges. First, as offline trajectories are usually fixed, they tend to cover limited state and action space. Second, the performance of model-based methods can be sensitive to the initialization of their parameters. In this work, we propose the variational latent branching model (VLBM) to learn the transition function of MDPs by formulating the environmental dynamics as a compact latent space, from which the next states and rewards are then sampled. Specifically, VLBM leverages and extends the variational inference framework with the recurrent state alignment (RSA), which is designed to capture as much information underlying the limited training data, by smoothing out the information flow between the variational (encoding) and generative (decoding) part of VLBM. Moreover, we also introduce the branching architecture to improve the model's robustness against randomly initialized model weights. The effectiveness of the VLBM is evaluated on the deep OPE (DOPE) benchmark, from which the training trajectories are designed to result in varied coverage of the state-action space. We show that the VLBM outperforms existing state-of-the-art OPE methods in general.  ( 2 min )

Privacy-preserving distributed distribution comparison measures the distance between the distributions whose data are scattered across different agents in a distributed system and cannot be shared among the agents. In this study, we propose a novel decentralized entropic optimal transport (EOT) method, which provides a privacy-preserving and communication-efficient solution to this problem with theoretical guarantees. In particular, we design a mini-batch randomized block-coordinate descent (MRBCD) scheme to optimize the decentralized EOT distance in its dual form. The dual variables are scattered across different agents and updated locally and iteratively with limited communications among partial agents. The kernel matrix involved in the gradients of the dual variables is estimated by a distributed kernel approximation method, and each agent only needs to approximate and store a sub-kernel matrix by one-shot communication and without sharing raw data. We analyze our method's communication complexity and provide a theoretical bound for the approximation error caused by the convergence error, the approximated kernel, and the mismatch between the storage and communication protocols. Experiments on synthetic data and real-world distributed domain adaptation tasks demonstrate the effectiveness of our method.  ( 2 min )

Many existing reinforcement learning (RL) methods employ stochastic gradient iteration on the back end, whose stability hinges upon a hypothesis that the data-generating process mixes exponentially fast with a rate parameter that appears in the step-size selection. Unfortunately, this assumption is violated for large state spaces or settings with sparse rewards, and the mixing time is unknown, making the step size inoperable. In this work, we propose an RL methodology attuned to the mixing time by employing a multi-level Monte Carlo estimator for the critic, the actor, and the average reward embedded within an actor-critic (AC) algorithm. This method, which we call \textbf{M}ulti-level \textbf{A}ctor-\textbf{C}ritic (MAC), is developed especially for infinite-horizon average-reward settings and neither relies on oracle knowledge of the mixing time in its parameter selection nor assumes its exponential decay; it, therefore, is readily applicable to applications with slower mixing times. Nonetheless, it achieves a convergence rate comparable to the state-of-the-art AC algorithms. We experimentally show that these alleviated restrictions on the technical conditions required for stability translate to superior performance in practice for RL problems with sparse rewards.  ( 2 min )

Assortment optimization has received active explorations in the past few decades due to its practical importance. Despite the extensive literature dealing with optimization algorithms and latent score estimation, uncertainty quantification for the optimal assortment still needs to be explored and is of great practical significance. Instead of estimating and recovering the complete optimal offer set, decision makers may only be interested in testing whether a given property holds true for the optimal assortment, such as whether they should include several products of interest in the optimal set, or how many categories of products the optimal set should include. This paper proposes a novel inferential framework for testing such properties. We consider the widely adopted multinomial logit (MNL) model, where we assume that each customer will purchase an item within the offered products with a probability proportional to the underlying preference score associated with the product. We reduce inferring a general optimal assortment property to quantifying the uncertainty associated with the sign change point detection of the marginal revenue gaps. We show the asymptotic normality of the marginal revenue gap estimator, and construct a maximum statistic via the gap estimators to detect the sign change point. By approximating the distribution of the maximum statistic with multiplier bootstrap techniques, we propose a valid testing procedure. We also conduct numerical experiments to assess the performance of our method.  ( 2 min )

Recent success of large-scale Contrastive Language-Image Pre-training (CLIP) has led to great promise in zero-shot semantic segmentation by transferring image-text aligned knowledge to pixel-level classification. However, existing methods usually require an additional image encoder or retraining/tuning the CLIP module. Here, we present a cost-effective strategy using text-prompt learning that keeps the entire CLIP module frozen while fully leveraging its rich information. Specifically, we propose a novel Zero-shot segmentation with Optimal Transport (ZegOT) method that matches multiple text prompts with frozen image embeddings through optimal transport, which allows each text prompt to efficiently focus on specific semantic attributes. Additionally, we propose Deep Local Feature Alignment (DLFA) that deeply aligns the text prompts with intermediate local feature of the frozen image encoder layers, which significantly boosts the zero-shot segmentation performance. Through extensive experiments on benchmark datasets, we show that our method achieves the state-of-the-art (SOTA) performance with only x7 lighter parameters compared to previous SOTA approaches.  ( 2 min )

Directed Exploration is a crucial challenge in reinforcement learning (RL), especially when rewards are sparse. Information-directed sampling (IDS), which optimizes the information ratio, seeks to do so by augmenting regret with information gain. However, estimating information gain is computationally intractable or relies on restrictive assumptions which prohibit its use in many practical instances. In this work, we posit an alternative exploration incentive in terms of the integral probability metric (IPM) between a current estimate of the transition model and the unknown optimal, which under suitable conditions, can be computed in closed form with the kernelized Stein discrepancy (KSD). Based on KSD, we develop a novel algorithm STEERING: \textbf{STE}in information dir\textbf{E}cted exploration for model-based \textbf{R}einforcement Learn\textbf{ING}. To enable its derivation, we develop fundamentally new variants of KSD for discrete conditional distributions. We further establish that STEERING archives sublinear Bayesian regret, improving upon prior learning rates of information-augmented MBRL, IDS included. Experimentally, we show that the proposed algorithm is computationally affordable and outperforms several prior approaches.  ( 2 min )

Recent ODE/SDE-based generative models, such as diffusion models and flow matching, define a generative process as a time reversal of a fixed forward process. Even though these models show impressive performance on large-scale datasets, numerical simulation requires multiple evaluations of a neural network, leading to a slow sampling speed. We attribute the reason to the high curvature of the learned generative trajectories, as it is directly related to the truncation error of a numerical solver. Based on the relationship between the forward process and the curvature, here we present an efficient method of training the forward process to minimize the curvature of generative trajectories without any ODE/SDE simulation. Experiments show that our method achieves a lower curvature than previous models and, therefore, decreased sampling costs while maintaining competitive performance. Code is available at https://github.com/sangyun884/fast-ode.  ( 2 min )

Ridgelet transform has been a fundamental mathematical tool in the theoretical studies of neural networks. However, the practical applicability of ridgelet transform to conducting learning tasks was limited since its numerical implementation by conventional classical computation requires an exponential runtime $\exp(O(D))$ as data dimension $D$ increases. To address this problem, we develop a quantum ridgelet transform (QRT), which implements the ridgelet transform of a quantum state within a linear runtime $O(D)$ of quantum computation. As an application, we also show that one can use QRT as a fundamental subroutine for quantum machine learning (QML) to efficiently find a sparse trainable subnetwork of large shallow wide neural networks without conducting large-scale optimization of the original network. This application discovers an efficient way in this regime to demonstrate the lottery ticket hypothesis on finding such a sparse trainable neural network. These results open an avenue of QML for accelerating learning tasks with commonly used classical neural networks.  ( 2 min )

Should we care whether AI systems have representations of the world that are similar to those of humans? We provide an information-theoretic analysis that suggests that there should be a U-shaped relationship between the degree of representational alignment with humans and performance on few-shot learning tasks. We confirm this prediction empirically, finding such a relationship in an analysis of the performance of 491 computer vision models. We also show that highly-aligned models are more robust to both adversarial attacks and domain shifts. Our results suggest that human-alignment is often a sufficient, but not necessary, condition for models to make effective use of limited data, be robust, and generalize well.  ( 2 min )

We present a subset selection algorithm designed to work with arbitrary model families in a practical batch setting. In such a setting, an algorithm can sample examples one at a time but, in order to limit overhead costs, is only able to update its state (i.e. further train model weights) once a large enough batch of examples is selected. Our algorithm, IWeS, selects examples by importance sampling where the sampling probability assigned to each example is based on the entropy of models trained on previously selected batches. IWeS admits significant performance improvement compared to other subset selection algorithms for seven publicly available datasets. Additionally, it is competitive in an active learning setting, where the label information is not available at selection time. We also provide an initial theoretical analysis to support our importance weighting approach, proving generalization and sampling rate bounds.  ( 2 min )

This paper introduces a computational framework to reconstruct and forecast a partially observed state that evolves according to an unknown or expensive-to-simulate dynamical system. Our reduced-order autodifferentiable ensemble Kalman filters (ROAD-EnKFs) learn a latent low-dimensional surrogate model for the dynamics and a decoder that maps from the latent space to the state space. The learned dynamics and decoder are then used within an ensemble Kalman filter to reconstruct and forecast the state. Numerical experiments show that if the state dynamics exhibit a hidden low-dimensional structure, ROAD-EnKFs achieve higher accuracy at lower computational cost compared to existing methods. If such structure is not expressed in the latent state dynamics, ROAD-EnKFs achieve similar accuracy at lower cost, making them a promising approach for surrogate state reconstruction and forecasting.  ( 2 min )

Can someone suggest a machine learning model that will segment audio spectrogram to multiple classes. I have labeled data of heart beats. S1, S2, systole and diastole. How to train a segmentation model ? submitted by /u/PlayfulMenu1395 [link] [comments]  ( 42 min )

Hi right now i have to implement a neural network from rapidminer into a python script to predict a value, but i cant get what is wrong with my program please help. import pandas as pd import math def sig(x): return 1 / (1 + math.exp(-x)) #Funcion de perceptron class Perceptron: #Constructor def __init__(self,weights,bias): self.weights = weights self.bias = bias self.output = 0 def setOutput(self,value): self.output = value def getBias(self): return self.bias def getOutput(self): return self.output def guess(self,input): sum = 0 for i in range(10): sum = sum + (input[i]*self.weights[i]) sum = sum + self.bias self.output = sig(sum) return self.output class Output: def __init__(self,nodes,threshold,name): self.nodes = nodes self.threshold = threshold self.name = name def guess(self,input):…  ( 42 min )

submitted by /u/BackgroundResult [link] [comments]  ( 40 min )

I am trying to write my own actor critic algorithm. Unlike other implementations, I tried to keep a separate actor and critic network. The problem arises somewhere in my actor or critic loss function ​ The error is originating here - advantage = nrml_disc_rewards-values critic_loss = advantage.pow(2).mean() actor_loss = -(torch.sum(torch.log(prob_batch)*advantage)) policy_opt.zero_grad() actor_loss.backward() policy_opt.step() value_opt.zero_grad() critic_loss.backward() value_opt.step() This is the full traceback - D:\q_learning\actor_critic.py:90: UserWarning: Creating a tensor from a list of numpy.ndarrays is extremely slow. Please consider converting the list to a single numpy.ndarray with numpy.array() before converting to a tensor. (Triggered internally at C:\cb\pytorch_100000…  ( 44 min )

Basically the title. I have a sequence of two papers - a viewpoint and a complete paper in the works - that I'm looking to submit, the viewpoint outlining the theoretical premise for the latter. I've currently had no luck finding any ML-specific journals that allow viewpoint submissions (with the exception of simply posting to arXiv), and was wondering if anyone here was familiar with any. Thanks :D submitted by /u/Adi-Dewan [link] [comments]  ( 42 min )

Openai is developing a new tool to help distinguish between AI-written and human-written text. Here is an unofficial python wrapper of openai model to detect if a text is written by #chatgpt , #gpt3 , #gpt etc Github: https://github.com/promptslab/openai-detector https://preview.redd.it/f45ggu45tgfa1.png?width=1122&format=png&auto=webp&s=4cb5ae70d7194cc3c070f3ad2dcbc968a804d4a3 submitted by /u/StoicBatman [link] [comments]  ( 42 min )

I am proud to announce the release of NoRefER, a multi-language referenceless ASR metric based on a fine-tuned language model, for public use on HuggingFace. This metric allows for evaluating the outputs of ASR models without needing a reference transcript, making it a valuable tool for a/b testing multiple ASR models or model versions, or even ensembling their outputs. ASR is an important technology with various applications, but the quality of ASR systems can vary greatly. It's important to accurately evaluate and compare the performance of different ASR models, traditionally done using reference-based ASR quality evaluation metrics. However, obtaining those ground-truth transcriptions from human annotators is time-consuming and costly. Referenceless quality evaluation is becoming impo…  ( 44 min )

https://www.youtube.com/watch?v=yvgxRzqx1Jg ​ Contents 00:00 Learning from Machine Learning Intro 00:21 Vincent Warmerdam Intro 01:18 Career Journey 03:25 What roles have you played? 05:44 Academic Background: Operations Research and Design 06:52 Operations Research 08:13 Mathematics 09:19 What attracted you to Machine Learning? 10:40 Calmcode 14:08 Calmcode, Do you use it? 15:22 Calmdcode, *args, **kwargs 16:23 If there were no constraints, what would you do to improve calmcode? 18:10 Open Source Projects: bulk, embetter, human-learn 19:10 Open Source: evol, scikit-lego 20:00 Rasa: Chatbots, Benchmarking 20:47 Unit Tests 21:42 Open Source: Creating Packages 24:10 Bulk, human-learn 26:20 27:03 Bulk in a notebook, bulk as a webapp 27:45 Human in the loop 29:03 Understanding the problem; Beans, Beef and Bread 32:56 Algorithm on the wrong problem 34:55 Module Improvement vs System Improvement 37:20 Does your answer make sense? 39:04 What's an important question that you believe remains unanswered in ML? 41:48 How do you view the gap between the hype and reality of AI? 46:28 Generative Models vs. Predictive Models 49:18 Jumping to solutions 50:08 Model vs. System 50:48 51:10 Who has influenced you in the field? 55:18 Humble, Caring Presenters 56:38 What's one piece of advice that you've received that's helped you? 01:00:18 Advice for people just starting in the field 01:03:15 What has a career in machine learning taught you about life? 01:05:16 SpaCy 01:06:10 Data-Centric Approach 01:06:50 Wrap-up 01:07:15 Follow, Explosion 01:07:48 Outro submitted by /u/NLPnerd [link] [comments]  ( 43 min )

Is it possible to finetune a generative model (like T5) to do something like this: { inputs: "XYZ XYZ was born in ABC. They now live in DEF.", targets: "XYZ born in ABC XYZ lives in DEF" } Like the transformer model fom this paper if so how should I go about approaching the problem? Is this task as simple as feeding it the inputs and targets or do you guys think it has more to it? submitted by /u/Zetsu-Eiyu-O [link] [comments]  ( 43 min )

What're some good open-source auto-ml services mainly for image classification that're similar to Google's Vertex-AI submitted by /u/binaryshrey [link] [comments]  ( 42 min )

Relying on hosted inference with LLMs in productions, such as via OpenAI API, has some challenges. The use of APIs should be designed around unstable latency, rate limits, token counts, costs, etc. To make it observable we've built tracing and monitoring specifically for AI apps. For example, the OpenAI Python library is monitored automatically, no need to do anything. We'll be adding support for more libraries. Here is a blog post with more info and screenshots: Monitor OpenAI API Latency, Tokens, Rate Limits, and More. And the GitHub repo. submitted by /u/l0g1cs [link] [comments]  ( 42 min )

Hi all, I'm trying to fine-tune Whisper AI to transcribe albanian speech to text but I have a problem in that I don't know how the dataset for training whisper model should look like. I already have voice audios and the transcript for that audio file but I need to know how to reformat it into a valid dataset for training Whisper. Thanks in advance! submitted by /u/ruizard [link] [comments]  ( 43 min )

This may be a silly question for those familiar with the field, but don't machine learning researchers expect any more prospects for traditional methods (I mean, "traditional" is other than deep learning)? I feel that most of the time when people talk about machine learning in the world today, they are referring to deep learning, but is this the same in the academic world? Have people who have been studying traditional methods switched to neural networks? I know that many researchers are excited about deep learning, but I am wondering what they think about other methods. submitted by /u/fujidaiti [link] [comments]  ( 52 min )

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I was curious to know if there are any particular layers which could be contributing to gradients vanishing and these vanishing gradients cascading down to subsequent lower layers, how to find these layers and if there has been any research work done on it ? submitted by /u/V1bicycle [link] [comments]  ( 41 min )

Hello, hoping I can get a simple question answered. How are features selected for neural nets where each instance in time has too much data to take in? Let’s say a 4K movie is going to play and we want to know if the next 3 seconds will contain X. We also don’t have a computer strong enough to take in all data at all times. Let’s say 20% of data is maxing our system. I have watched a ton of videos about how layers work but how does the NN take samples to put those samples into its filter? Is it up to the programmer to find clever ways of filtering down the data into certain “indicators” or something? submitted by /u/Joebone87 [link] [comments]  ( 41 min )

Biologically plausible neural networks? So I'm wondering if you could possibly design ANN to simulate action potentials of neurons, and train them to do various tasks. I would hope that you can accurately simulate specific patterns of neural activity, when running a task. I'm sure this has already been done, but I'm wondering how big of a task it is to accomplish. Thanks! submitted by /u/daddydilly694-20 [link] [comments]  ( 42 min )

I'm developing a recurrent neural network in python using keras to do binary classification on roulette wheel data. I'm trying to compile my code but it's crashing, could you help me fix the code please? Here is my code from keras.models import Sequential from keras.layers import Dense, Dropout from sklearn.preprocessing import MinMaxScaler import numpy as np import pandas as pd columns = ['data', 'resultado'] base = pd.read_csv("blaze_values_27_01_2023_VERMELHO_1.csv", header = None, names = columns) base = base.dropna() base_treinamento = base.iloc[:, 1:2] normalizador = MinMaxScaler(feature_range=[0,1]) base_treinamento_normalizada = normalizador.fit_transform(base_treinamento) previsores = [] saida_real = [] for i in range (90,1809): previsores.append(base_treinamento_normalizada[i-9…  ( 42 min )

submitted by /u/oridnary_artist [link] [comments]  ( 40 min )

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Hello humans! A project is about to start (https://github.com/neuralshare) which will allow any device, even low-cpu, to use and interact with AI models that they could not use since they require so many hardware resources. The project is called NeuralShare and will use the Stellar network to achieve its goal, as you can read on the README on Github at the link on this post. More specifically, it will use the Futurenet network and to achieve its purpose it will use the NEUR token, also on Futurenet, which was already created a little while ago and has no real value, has no speculative objective but only has one purpose, namely that of the project. We plan to distribute this token as an airdrop, totally free of course, and anyone who has this token will be able to use and interact with GPT-3 or other AI models for free simply by sending a NEUR transaction with a text memo attached containing the prompt. In return you will receive back a transaction with a text memo containing the response. However, this will only be possible when there are enough nodes (go to github to understand why),the precise number of nodes that must be active before the response can be received is still to be defined . For more details and updates you can add yourself to Discord, find the links on the README file on GitHub, as well as more details on the functioning of this method which will also allow you to use GPT-3 for free and without an api-key submitted by /u/0ut0flin3 [link] [comments]  ( 43 min )

I do not even remember signing up for an AI newsletter but I got an issue today from “AINow” that was actually pretty insightful/informative. Thought I’d share it as I see frequent posts asking where ppl get their info/news from. Newsletter Here submitted by /u/iwjahshehbs [link] [comments]  ( 40 min )

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submitted by /u/SpeaKrLipSync [link] [comments]  ( 41 min )

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Lot of ok-ish voice cloning and conversion tools are available in market, but most have an American English tone to them. What are the opensource SOTA for voice conversion and/or voice cloning for the Indic languages ? submitted by /u/Maleficent_Suit1591 [link] [comments]  ( 40 min )

submitted by /u/Maleficent_Suit1591 [link] [comments]  ( 40 min )

I'm studying computer networking but I'm certain that AI can easily set up virtual networks and cloud computing solutions on their own. Should I have followed my dream to become a bricklayer? submitted by /u/black_linux_guy [link] [comments]  ( 41 min )

Does anybody know how people on Instagram and TikTok are creating these AI music videos? I see them everywhere but they gatekeep what ever they’re using. submitted by /u/mynameisbob1011 [link] [comments]  ( 40 min )

submitted by /u/Maleficent_Suit1591 [link] [comments]  ( 40 min )

Hello all! ​ I am new to this subreddit, but I have begun the fascinating descent into learning about all things AI and its ilk. I would like your help. ​ I want to turn on the firehose and consume all the content I can. ​ - What are your favorite news sources and media creators? ​ - How do you find the latest tools and research papers? ​ - How do you see where the conversation is going and stay updated with new opinions? ​ This would be incredibly helpful, and I hope I posted right. submitted by /u/WaffleHouseBaby [link] [comments]  ( 41 min )

Hi All -- I've been in IT for about 15 years. I started as a sysadmin, segued into dev work, and have been specializing in systems & data integration and business process automation for the past 5ish years. I also studied Computer Science for 4 years but never graduated (that's a whole other sobstory -- won't bore anyone with that) I've been considering the direction I want to go for the next leg of my career and I feel like AI/ML is the logical next step. I've started building a portfolio of my AI/ML projects and I'd like to pick up a cert or two to compliment them. My ultimate goal is solutions architecture, but I love the engineering side of things and expect to start there. What I want to know is what certifications everyone would recommend -- I've been eyeing the IBM-sponsored certificate tracks on Coursera but I've seen a few others and they all have their merits. I'm just not sure how much value they carry in the job market. Are there any worth staying well away from? submitted by /u/am_i_the_rabbit [link] [comments]  ( 41 min )

Soon we will have very powerful assistants.They can interact with databases directly.E.g. you ask for news articles from BBC.In the case of assistants they don't need human readable url.They can sql query database on 192.168.1.1 with ease.And then they present the data in appropriate format.And dht is just for discovery. submitted by /u/nikitastaf1996 [link] [comments]  ( 41 min )

submitted by /u/liquidocelotYT [link] [comments]  ( 40 min )

submitted by /u/Mental_Character7367 [link] [comments]  ( 40 min )

At DocuStack, our goal is to help organisations turn their internal knowledge into an answering bot, saving time and increasing efficiency for teams. If you're familiar with the challenges of managing internal knowledge and answering repetitive questions, I believe you will find DocuStack to be a valuable tool. With features such as a searchable database, customisable answers, multi-language support, and offline file upload capabilities, DocuStack makes it easy to manage your internal knowledge and provide quick, accurate answers to your team. Here is the link https://www.docustack.ai/chat This is our first launch of a wider product for customer support. would love to hear your thoughts and do not forget join the waitlist, if you would want to try the beta version. submitted by /u/titansaurabh [link] [comments]  ( 41 min )

Hello everyone. I'm passionate about AI and just computer science in general. I would like to participate in a Science and Engineering Fair, but I want to have an idea of what I'm going to do first. What can I do involving AI and do very well in the fair? If not AI, then computer science in general. Thank you submitted by /u/Sufficient-Ad-8881 [link] [comments]  ( 42 min )

submitted by /u/Tao_Dragon [link] [comments]  ( 40 min )

submitted by /u/anuratya [link] [comments]  ( 43 min )

I’m doing RL on a problem where I learn 2 actions and my reward = action 1 - action 2. Since action 2 is getting subtracted, the agent learns to output 0.0 value for action 2 (action space for both the actions is between 0.0 and 0.1). Can someone please advice how can I make the agent explore non-zero values for action 2. submitted by /u/HonestScratch1827 [link] [comments]  ( 41 min )

I would like to invite interested people to collaborate on this hobby project of mine. This is still in an early-stage, and I believe it can be significantly improved together. The GitHub repository link is here: https://github.com/kayuksel/multi-rl-crowd-sim Note: The difference from StarCraft is that Dragons can hide behind each other. They also reduce their strength of hitting, propotional to decrease of their health. https://preview.redd.it/wrpcaz782dfa1.png?width=640&format=png&auto=webp&s=1dede69acb78e874a80bd532af85b269c7117f9f submitted by /u/k_yuksel [link] [comments]  ( 41 min )

Has anyone ever monitored the behavior of alpha in autotuned SAC ? I implemented it and it seems to work, but I would be interested in seeing a commented graph of the evolution of alpha during the learning process, and I could not find a contribution including this. submitted by /u/Scrimbibete [link] [comments]  ( 41 min )

Hi all, I'm training an Agent (to control a platform to maintain attitude) but I'm having problems understanding the following behavior: R = A - penalty I thought adding 1.0 would increase the cumulative reward but that's not the case. R1 = A - penalty + 1.0 R1 ends up being less than R. ​ In light of this, I multiplied penalty by 10 to see what happens: R2 = A - 10.0*penalty This, increases cumulative reward (R2 > R). ​ Note that 'A' and 'penalty' are always positive values. Any idea what this means (and how to go about shaping R)? submitted by /u/XecutionStyle [link] [comments]  ( 46 min )

Analyst reports. Academic papers. Ph.D. programs. There are a lot of places you can go to get a glimpse of the future. But the best place might just be El Coyote Cojo, a whiskey-soaked dive bar that doesn’t exist in real life. Fire up Cyberpunk 2077 and you’ll see much more than the watering hole’s Read article >  ( 6 min )

Broadcasters have an arsenal of new features and technologies at their disposal; the eighth-generation NVIDIA video encoder on RTX 40 Series GPUs with support for the open AV1 video-coding format; new NVIDIA Broadcast app effects like Eye Contact and Vignette; and support for AV1 streaming in Discord.  ( 7 min )

We’re launching a classifier trained to distinguish between AI-written and human-written text. We’ve trained a classifier to distinguish between text written by a human and text written by AIs from a variety of providers. While it is impossible to reliably detect all AI-written text, we believe  ( 3 min )

I’m sure you’ve run into this situation yourself. You’re at a family gathering, and someone at the table asks you exactly what you do for a living. Maybe it’s your uncle, a grandparent, or a child. You try to describe in simple terms what you do, but they get a mystified expression on their face.… Read More »Explaining FAIR Data to Aunt Doris The post Explaining FAIR Data to Aunt Doris appeared first on Data Science Central.  ( 21 min )

Java has been a prevalent programming language. Even today, it remains one of the top three most-used languages for developing enterprise software. New cloud-native Java runtimes must provide developers with the following four significant benefits. It helps build cloud-native, microservices, and serverless Java applications: Traditional Java applications run as containers on hardware servers that control… Read More »Java in Cloud Native Environment: All You Need To Know The post Java in Cloud Native Environment: All You Need To Know appeared first on Data Science Central.  ( 20 min )

The National Institute of Standards and Technology (NIST) has released it’s Artificial Intelligence Risk Management Framework (AI RMF 1.0), a guidance document for voluntary use by organizations designing, developing, deploying, or using AI systems to help manage the many risks of AI technologies. The NIST AI Risk standards provide a practical and bipartisan perspective for… Read More »NIST Artificial Intelligence Risk Management Framework The post NIST Artificial Intelligence Risk Management Framework appeared first on Data Science Central.  ( 19 min )

In the previous article, we looked at two Ever-Successful NFL teams, the Kansas City Chiefs and the San Francisco 49ers, who seem to be able to win consistently even while things change around them and players and coaches come and go.  Then, we looked at two Never-Successful teams, the Arizona Cardinals and the Cleveland Browns,… Read More »Exploding vs. Imploding: What the NFL Has to Teach Us About Managing Agile Enterprises, Part II The post Exploding vs. Imploding: What the NFL Has to Teach Us About Managing Agile Enterprises, Part II appeared first on Data Science Central.  ( 26 min )

Suppose f(x) and g(x) are functions that are each proportional to their second derivative. These include exponential, circular, and hyperbolic functions. Then the integral of f(x) g(x) can be computed in closed form with a moderate amount of work. The first time you see how such integrals are computed, it’s an interesting trick. I wrote […] Avoid having to integrate by parts twice first appeared on John D. Cook.  ( 5 min )

The recent surge in popularity of diffusion models for image generation has brought new attention to the potential of these models in other areas of media synthesis. One area that has yet to be fully explored is the application of diffusion models to music generation. Music generation requires to handle multiple aspects, including the temporal dimension, long-term structure, multiple layers of overlapping sounds, and nuances that only trained listeners can detect. In our work, we investigate the potential of diffusion models for text-conditional music generation. We develop a cascading latent diffusion approach that can generate multiple minutes of high-quality stereo music at 48kHz from textual descriptions. For each model, we make an effort to maintain reasonable inference speed, targeting real-time on a single consumer GPU. In addition to trained models, we provide a collection of open-source libraries with the hope of facilitating future work in the field. We open-source the following: - Music samples for this paper: https://bit.ly/anonymous-mousai - All music samples for all models: https://bit.ly/audio-diffusion - Codes: https://github.com/archinetai/audio-diffusion-pytorch  ( 2 min )

Personalised federated learning (FL) aims at collaboratively learning a machine learning model taylored for each client. Albeit promising advances have been made in this direction, most of existing approaches works do not allow for uncertainty quantification which is crucial in many applications. In addition, personalisation in the cross-device setting still involves important issues, especially for new clients or those having small number of observations. This paper aims at filling these gaps. To this end, we propose a novel methodology coined FedPop by recasting personalised FL into the population modeling paradigm where clients' models involve fixed common population parameters and random effects, aiming at explaining data heterogeneity. To derive convergence guarantees for our scheme, we introduce a new class of federated stochastic optimisation algorithms which relies on Markov chain Monte Carlo methods. Compared to existing personalised FL methods, the proposed methodology has important benefits: it is robust to client drift, practical for inference on new clients, and above all, enables uncertainty quantification under mild computational and memory overheads. We provide non-asymptotic convergence guarantees for the proposed algorithms and illustrate their performances on various personalised federated learning tasks.  ( 2 min )

Denoising Diffusion Probabilistic Models have shown an impressive generation quality, although their long sampling chain leads to high computational costs. In this paper, we observe that a long sampling chain also leads to an error accumulation phenomenon, which is similar to the \textbf{exposure bias} problem in autoregressive text generation. Specifically, we note that there is a discrepancy between training and testing, since the former is conditioned on the ground truth samples, while the latter is conditioned on the previously generated results. To alleviate this problem, we propose a very simple but effective training regularization, consisting in perturbing the ground truth samples to simulate the inference time prediction errors. We empirically show that the proposed input perturbation leads to a significant improvement of the sample quality while reducing both the training and the inference times. For instance, on CelebA 64$\times$64, we achieve a new state-of-the-art FID score of 1.27, while saving 37.5% of the training time.  ( 2 min )

Recent literature has shown that features obtained from supervised training of CNNs may over-emphasize texture rather than encoding high-level information. In self-supervised learning in particular, texture as a low-level cue may provide shortcuts that prevent the network from learning higher level representations. To address these problems we propose to use classic methods based on anisotropic diffusion to augment training using images with suppressed texture. This simple method helps retain important edge information and suppress texture at the same time. We empirically show that our method achieves state-of-the-art results on object detection and image classification with eight diverse datasets in either supervised or self-supervised learning tasks such as MoCoV2 and Jigsaw. Our method is particularly effective for transfer learning tasks and we observed improved performance on five standard transfer learning datasets. The large improvements (up to 11.49\%) on the Sketch-ImageNet dataset, DTD dataset and additional visual analyses with saliency maps suggest that our approach helps in learning better representations that better transfer.  ( 2 min )

Recently, graph neural networks (GNNs) have shown success at learning representations of brain graphs derived from functional magnetic resonance imaging (fMRI) data. The majority of existing GNN methods, however, assume brain graphs are static over time and the graph adjacency matrix is known prior to model training. These assumptions are at odds with neuroscientific evidence that brain graphs are time-varying with a connectivity structure that depends on the choice of functional connectivity measure. Noisy brain graphs that do not truly represent the underling fMRI data can have a detrimental impact on the performance of GNNs. As a solution, we propose Dynamic Brain Graph Structure Learning (DBGSL), a novel method for learning the optimal time-varying dependency structure of fMRI data induced by a downstream prediction task. Experiments demonstrate DBGSL achieves state-of-the-art performance for sex classification using real-world resting-state and task fMRI data. Moreover, analysis of the learnt dynamic graphs highlights prediction-related brain regions which align with existing neuroscience literature.  ( 2 min )

Learning a predictive model of the mean return, or value function, plays a critical role in many reinforcement learning algorithms. Distributional reinforcement learning (DRL) methods instead model the value distribution, which has been shown to improve performance in many settings. In this paper, we model the value distribution as approximately normal using the Markov Chain central limit theorem. We analytically compute quantile bars to provide a new DRL target that is informed by the decrease in standard deviation that occurs over the course of an episode. In addition, we propose a policy update strategy based on uncertainty as measured by structural characteristics of the value distribution not present in the standard value function. The approach we outline is compatible with many DRL structures. We use two representative on-policy algorithms, PPO and TRPO, as testbeds and show that our methods produce performance improvements in continuous control tasks.  ( 2 min )

How best to incorporate historical data to "warm start" bandit algorithms is an open question: naively initializing reward estimates using all historical samples can suffer from spurious data and imbalanced data coverage, leading to computational and storage issues $\unicode{x2014}$ particularly salient in continuous action spaces. We propose Artificial Replay, a meta-algorithm for incorporating historical data into any arbitrary base bandit algorithm. Artificial Replay uses only a fraction of the historical data compared to a full warm-start approach, while still achieving identical regret for base algorithms that satisfy independence of irrelevant data (IIData), a novel and broadly applicable property that we introduce. We complement these theoretical results with experiments on $K$-armed and continuous combinatorial bandit algorithms, including a green security domain using real poaching data. We show the practical benefits of Artificial Replay, including for base algorithms that do not satisfy IIData.  ( 2 min )

Deep neural networks (DNNs) have proven to be highly effective in a variety of tasks, making them the go-to method for problems requiring high-level predictive power. Despite this success, the inner workings of DNNs are often not transparent, making them difficult to interpret or understand. This lack of interpretability has led to increased research on inherently interpretable neural networks in recent years. Models such as Neural Additive Models (NAMs) achieve visual interpretability through the combination of classical statistical methods with DNNs. However, these approaches only concentrate on mean response predictions, leaving out other properties of the response distribution of the underlying data. We propose Neural Additive Models for Location Scale and Shape (NAMLSS), a modelling framework that combines the predictive power of classical deep learning models with the inherent advantages of distributional regression while maintaining the interpretability of additive models.  ( 2 min )

The classic Reinforcement Learning (RL) formulation concerns the maximization of a scalar reward function. More recently, convex RL has been introduced to extend the RL formulation to all the objectives that are convex functions of the state distribution induced by a policy. Notably, convex RL covers several relevant applications that do not fall into the scalar formulation, including imitation learning, risk-averse RL, and pure exploration. In classic RL, it is common to optimize an infinite trials objective, which accounts for the state distribution instead of the empirical state visitation frequencies, even though the actual number of trajectories is always finite in practice. This is theoretically sound since the infinite trials and finite trials objectives can be proved to coincide and thus lead to the same optimal policy. In this paper, we show that this hidden assumption does not hold in the convex RL setting. In particular, we show that erroneously optimizing the infinite trials objective in place of the actual finite trials one, as it is usually done, can lead to a significant approximation error. Since the finite trials setting is the default in both simulated and real-world RL, we believe shedding light on this issue will lead to better approaches and methodologies for convex RL, impacting relevant research areas such as imitation learning, risk-averse RL, and pure exploration among others.  ( 2 min )

Recent years have witnessed many successful applications of contrastive learning in diverse domains, yet its self-supervised version still remains many exciting challenges. As the negative samples are drawn from unlabeled datasets, a randomly selected sample may be actually a false negative to an anchor, leading to incorrect encoder training. This paper proposes a new self-supervised contrastive loss called the BCL loss that still uses random samples from the unlabeled data while correcting the resulting bias with importance weights. The key idea is to design the desired sampling distribution for sampling hard true negative samples under the Bayesian framework. The prominent advantage lies in that the desired sampling distribution is a parametric structure, with a location parameter for debiasing false negative and concentration parameter for mining hard negative, respectively. Experiments validate the effectiveness and superiority of the BCL loss.  ( 2 min )

Though anomaly detection (AD) can be viewed as a classification problem (nominal vs. anomalous) it is usually treated in an unsupervised manner since one typically does not have access to, or it is infeasible to utilize, a dataset that sufficiently characterizes what it means to be "anomalous." In this paper we present results demonstrating that this intuition surprisingly seems not to extend to deep AD on images. For a recent AD benchmark on ImageNet, classifiers trained to discern between normal samples and just a few (64) random natural images are able to outperform the current state of the art in deep AD. Experimentally we discover that the multiscale structure of image data makes example anomalies exceptionally informative.  ( 2 min )

Lifelong learning aims to create AI systems that continuously and incrementally learn during a lifetime, similar to biological learning. Attempts so far have met problems, including catastrophic forgetting, interference among tasks, and the inability to exploit previous knowledge. While considerable research has focused on learning multiple input distributions, typically in classification, lifelong reinforcement learning (LRL) must also deal with variations in the state and transition distributions, and in the reward functions. Modulating masks, recently developed for classification, are particularly suitable to deal with such a large spectrum of task variations. In this paper, we adapted modulating masks to work with deep LRL, specifically PPO and IMPALA agents. The comparison with LRL baselines in both discrete and continuous RL tasks shows superior performance. We further investigated the use of a linear combination of previously learned masks to exploit previous knowledge when learning new tasks: not only is learning faster, the algorithm solves tasks that we could not otherwise solve from scratch due to extremely sparse rewards. The results suggest that RL with modulating masks is a promising approach to lifelong learning, to the composition of knowledge to learn increasingly complex tasks, and to knowledge reuse for efficient and faster learning.  ( 2 min )

Stochastic versions of proximal methods have gained much attention in statistics and machine learning. These algorithms tend to admit simple, scalable forms, and enjoy numerical stability via implicit updates. In this work, we propose and analyze a stochastic version of the recently proposed proximal distance algorithm, a class of iterative optimization methods that recover a desired constrained estimation problem as a penalty parameter $\rho \rightarrow \infty$. By uncovering connections to related stochastic proximal methods and interpreting the penalty parameter as the learning rate, we justify heuristics used in practical manifestations of the proximal distance method, establishing their convergence guarantees for the first time. Moreover, we extend recent theoretical devices to establish finite error bounds and a complete characterization of convergence rates regimes. We validate our analysis via a thorough empirical study, also showing that unsurprisingly, the proposed method outpaces batch versions on popular learning tasks.  ( 2 min )

Although many methods have been proposed to estimate attributions of input variables, there still exists a significant theoretical flaw in masking-based attribution methods, i.e., it is hard to examine whether the masking method faithfully represents the absence of input variables. Specifically, for masking-based attributions, setting an input variable to the baseline value is a typical way of representing the absence of the variable. However, there are no studies investigating how to represent the absence of input variables and verify the faithfulness of baseline values. Therefore, we revisit the feature representation of a DNN in terms of causality, and propose to use causal patterns to examine whether the masking method faithfully removes information encoded in input variables. More crucially, it is proven that the causality can be explained as the elementary rationale of the Shapley value. Furthermore, we define the optimal baseline value from the perspective of causality, and we propose a method to learn the optimal baseline value. Experimental results have demonstrated the effectiveness of our method.  ( 2 min )

Behavioral cloning (BC) can recover a good policy from abundant expert data, but may fail when expert data is insufficient. This paper considers a situation where, besides the small amount of expert data, a supplementary dataset is available, which can be collected cheaply from sub-optimal policies. Imitation learning with a supplementary dataset is an emergent practical framework, but its theoretical foundation remains under-developed. To advance understanding, we first investigate a direct extension of BC, called NBCU, that learns from the union of all available data. Our analysis shows that, although NBCU suffers an imitation gap that is larger than BC in the worst case, there exist special cases where NBCU performs better than or equally well as BC. This discovery implies that noisy data can also be helpful if utilized elaborately. Therefore, we further introduce a discriminator-based importance sampling technique to re-weight the supplementary data, proposing the WBCU method. With our newly developed landscape-based analysis, we prove that WBCU can outperform BC in mild conditions. Empirical studies show that WBCU simultaneously achieves the best performance on two challenging tasks where prior state-of-the-art methods fail.  ( 2 min )

Recently, significant progress has been made regarding the statistical understanding of artificial neural networks (ANNs). ANNs are motivated by the functioning of the brain, but differ in several crucial aspects. In particular, it is biologically implausible that the learning of the brain is based on gradient descent. In this work we look at the brain as a statistical method for supervised learning. The main contribution is to relate the local updating rule of the connection parameters in biological neural networks (BNNs) to a zero-order optimization method.  ( 2 min )

The complexity of designing reward functions has been a major obstacle to the wide application of deep reinforcement learning (RL) techniques. Describing an agent's desired behaviors and properties can be difficult, even for experts. A new paradigm called reinforcement learning from human preferences (or preference-based RL) has emerged as a promising solution, in which reward functions are learned from human preference labels among behavior trajectories. However, existing methods for preference-based RL are limited by the need for accurate oracle preference labels. This paper addresses this limitation by developing a method for crowd-sourcing preference labels and learning from diverse human preferences. The key idea is to stabilize reward learning through regularization and correction in a latent space. To ensure temporal consistency, a strong constraint is imposed on the reward model that forces its latent space to be close to the prior distribution. Additionally, a confidence-based reward model ensembling method is designed to generate more stable and reliable predictions. The proposed method is tested on a variety of tasks in DMcontrol and Meta-world and has shown consistent and significant improvements over existing preference-based RL algorithms when learning from diverse feedback, paving the way for real-world applications of RL methods.  ( 2 min )

We present Myriad, a testbed written in JAX for learning and planning in real-world continuous environments. The primary contributions of Myriad are threefold. First, Myriad provides machine learning practitioners access to trajectory optimization techniques for application within a typical automatic differentiation workflow. Second, Myriad presents many real-world optimal control problems, ranging from biology to medicine to engineering, for use by the machine learning community. Formulated in continuous space and time, these environments retain some of the complexity of real-world systems often abstracted away by standard benchmarks. As such, Myriad strives to serve as a stepping stone towards application of modern machine learning techniques for impactful real-world tasks. Finally, we use the Myriad repository to showcase a novel approach for learning and control tasks. Trained in a fully end-to-end fashion, our model leverages an implicit planning module over neural ordinary differential equations, enabling simultaneous learning and planning with complex environment dynamics.

Explainability has become a central requirement for the development, deployment, and adoption of machine learning (ML) models and we are yet to understand what explanation methods can and cannot do. Several factors such as data, model prediction, hyperparameters used in training the model, and random initialization can all influence downstream explanations. While previous work empirically hinted that explanations (E) may have little relationship with the prediction (Y), there is a lack of conclusive study to quantify this relationship. Our work borrows tools from causal inference to systematically assay this relationship. More specifically, we measure the relationship between E and Y by measuring the treatment effect when intervening on their causal ancestors (hyperparameters) (inputs to generate saliency-based Es or Ys). We discover that Y's relative direct influence on E follows an odd pattern; the influence is higher in the lowest-performing models than in mid-performing models, and it then decreases in the top-performing models. We believe our work is a promising first step towards providing better guidance for practitioners who can make more informed decisions in utilizing these explanations by knowing what factors are at play and how they relate to their end task.

Handling out-of-distribution (OOD) samples has become a major stake in the real-world deployment of machine learning systems. This work explores the application of self-supervised contrastive learning to the simultaneous detection of two types of OOD samples: unseen classes and adversarial perturbations. Since in practice the distribution of such samples is not known in advance, we do not assume access to OOD examples. We first show that similarity functions trained with contrastive learning can be leveraged with the maximum mean discrepancy (MMD) two-sample test to verify whether two independent sets of samples are drawn from the same distribution. Inspired by this approach, we introduce CADet (Contrastive Anomaly Detection), a method based on contrastive transformations to perform anomaly detection on single samples. CADet compares favorably to adversarial detection methods to detect adversarially perturbed samples on ImageNet. Simultaneously, it achieves comparable performance to unseen label detection methods on two challenging benchmarks: ImageNet-O and iNaturalist. CADet is fully self-supervised and requires neither labels for in-distribution samples nor access to OOD examples.

Foundation models are redefining how AI systems are built. Practitioners now follow a standard procedure to build their machine learning solutions: from a pre-trained foundation model, they fine-tune the weights on the target task of interest. So, the Internet is swarmed by a handful of foundation models fine-tuned on many diverse tasks: these individual fine-tunings exist in isolation without benefiting from each other. In our opinion, this is a missed opportunity, as these specialized models contain rich and diverse features. In this paper, we thus propose model ratatouille, a new strategy to recycle the multiple fine-tunings of the same foundation model on diverse auxiliary tasks. Specifically, we repurpose these auxiliary weights as initializations for multiple parallel fine-tunings on the target task; then, we average all fine-tuned weights to obtain the final model. This recycling strategy aims at maximizing the diversity in weights by leveraging the diversity in auxiliary tasks. Empirically, it improves the state of the art on the reference DomainBed benchmark for out-of-distribution generalization. Looking forward, this work contributes to the emerging paradigm of updatable machine learning where, akin to open-source software development, the community collaborates to reliably update machine learning models.

We propose a goodness-of-fit measure for probability densities modeling observations with varying dimensionality, such as text documents of differing lengths or variable-length sequences. The proposed measure is an instance of the kernel Stein discrepancy (KSD), which has been used to construct goodness-of-fit tests for unnormalized densities. The KSD is defined by its Stein operator: current operators used in testing apply to fixed-dimensional spaces. As our main contribution, we extend the KSD to the variable-dimension setting by identifying appropriate Stein operators, and propose a novel KSD goodness-of-fit test. As with the previous variants, the proposed KSD does not require the density to be normalized, allowing the evaluation of a large class of models. Our test is shown to perform well in practice on discrete sequential data benchmarks.

Learning adversarial examples can be formulated as an optimization problem of maximizing the loss function with some box-constraints. However, for solving this induced optimization problem, the state-of-the-art gradient-based methods such as FGSM, I-FGSM and MI-FGSM look different from their original methods especially in updating the direction, which makes it difficult to understand them and then leaves some theoretical issues to be addressed in viewpoint of optimization. In this paper, from the perspective of adapting step-size, we provide a unified theoretical interpretation of these gradient-based adversarial learning methods. We show that each of these algorithms is in fact a specific reformulation of their original gradient methods but using the step-size rules with only current gradient information. Motivated by such analysis, we present a broad class of adaptive gradient-based algorithms based on the regular gradient methods, in which the step-size strategy utilizing information of the accumulated gradients is integrated. Such adaptive step-size strategies directly normalize the scale of the gradients rather than use some empirical operations. The important benefit is that convergence for the iterative algorithms is guaranteed and then the whole optimization process can be stabilized. The experiments demonstrate that our AdaI-FGM consistently outperforms I-FGSM and AdaMI-FGM remains competitive with MI-FGSM for black-box attacks.

Suppose there are $N$ units and $D$ interventions. We aim to learn the average potential outcome associated with every unit-intervention pair, i.e., $N \times D$ causal parameters. While running $N \times D$ experiments is conceivable, it can be expensive or infeasible. This work introduces an experiment design, synthetic A/B testing, and the synthetic interventions (SI) estimator to recover all $N \times D$ causal parameters while observing each unit under at most two interventions, independent of $D$. Under a novel tensor factor model for potential outcomes across units, measurements, and interventions, we establish the identification of each parameter. Further, we show the SI estimator is finite-sample consistent and asymptotically normal. Collectively, these also lead to novel results for panel data settings, particularly for synthetic controls. We empirically validate our experiment design using real e-commerce data from a large-scale A/B test.

Federated Learning (FL) has emerged as a promising framework for distributed training of AI-based services, applications, and network procedures in 6G. One of the major challenges affecting the performance and efficiency of 6G wireless FL systems is the massive scheduling of user devices over resource-constrained channels. In this work, we argue that the uplink scheduling of FL client devices is a problem with a rich relational structure. To address this challenge, we propose a novel, energy-efficient, and importance-aware metric for client scheduling in FL applications by leveraging Unsupervised Graph Representation Learning (UGRL). Our proposed approach introduces a relational inductive bias in the scheduling process and does not require the collection of training feedback information from client devices, unlike state-of-the-art importance-aware mechanisms. We evaluate our proposed solution against baseline scheduling algorithms based on recently proposed metrics in the literature. Results show that, when considering scenarios of nodes exhibiting spatial relations, our approach can achieve an average gain of up to 10% in model accuracy and up to 17 times in energy efficiency compared to state-of-the-art importance-aware policies.

Symbolic Regression (SR) can generate interpretable, concise expressions that fit a given dataset, allowing for more human understanding of the structure than black-box approaches. The addition of background knowledge (in the form of symbolic mathematical constraints) allows for the generation of expressions that are meaningful with respect to theory while also being consistent with data. We specifically examine the addition of constraints to traditional genetic algorithm (GA) based SR (PySR) as well as a Markov-chain Monte Carlo (MCMC) based Bayesian SR architecture (Bayesian Machine Scientist), and apply these to rediscovering adsorption equations from experimental, historical datasets. We find that, while hard constraints prevent GA and MCMC SR from searching, soft constraints can lead to improved performance both in terms of search effectiveness and model meaningfulness, with computational costs increasing by about an order-of-magnitude. If the constraints do not correlate well with the dataset or expected models, they can hinder the search of expressions. We find Bayesian SR is better these constraints (as the Bayesian prior) than by modifying the fitness function in the GA

Nonlinear inter-modality registration is often challenging due to the lack of objective functions that are good proxies for alignment. Here we propose a synthesis-by-registration method to convert this problem into an easier intra-modality task. We introduce a registration loss for weakly supervised image translation between domains that does not require perfectly aligned training data. This loss capitalises on a registration U-Net with frozen weights, to drive a synthesis CNN towards the desired translation. We complement this loss with a structure preserving constraint based on contrastive learning, which prevents blurring and content shifts due to overfitting. We apply this method to the registration of histological sections to MRI slices, a key step in 3D histology reconstruction. Results on two different public datasets show improvements over registration based on mutual information (13% reduction in landmark error) and synthesis-based algorithms such as CycleGAN (11% reduction), and are comparable to a registration CNN with label supervision. Code and data are publicly available at \url{https://github.com/acasamitjana/SynthByReg}

The completeness axiom renders the explanation of a post-hoc XAI method only locally faithful to the model, i.e. for a single decision. For the trustworthy application of XAI, in particular for high-stake decisions, a more global model understanding is required. Recently, concept-based methods have been proposed, which are however not guaranteed to be bound to the actual model reasoning. To circumvent this problem, we propose Multi-dimensional Concept Discovery (MCD) as an extension of previous approaches that fulfills a completeness relation on the level of concepts. Our method starts from general linear subspaces as concepts and does neither require reinforcing concept interpretability nor re-training of model parts. We propose sparse subspace clustering to discover improved concepts and fully leverage the potential of multi-dimensional subspaces. MCD offers two complementary analysis tools for concepts in input space: (1) concept activation maps, that show where a concept is expressed within a sample, allowing for concept characterization through prototypical samples, and (2) concept relevance heatmaps, that decompose the model decision into concept contributions. Both tools together enable a detailed understanding of the model reasoning, which is guaranteed to relate to the model via a completeness relation. This paves the way towards more trustworthy concept-based XAI. We empirically demonstrate the superiority of MCD against more constrained concept definitions.

Modern mobile devices have access to a wealth of data suitable for learning models, which in turn can greatly improve the user experience on the device. For example, language models can improve speech recognition and text entry, and image models can automatically select good photos. However, this rich data is often privacy sensitive, large in quantity, or both, which may preclude logging to the data center and training there using conventional approaches. We advocate an alternative that leaves the training data distributed on the mobile devices, and learns a shared model by aggregating locally-computed updates. We term this decentralized approach Federated Learning. We present a practical method for the federated learning of deep networks based on iterative model averaging, and conduct an extensive empirical evaluation, considering five different model architectures and four datasets. These experiments demonstrate the approach is robust to the unbalanced and non-IID data distributions that are a defining characteristic of this setting. Communication costs are the principal constraint, and we show a reduction in required communication rounds by 10-100x as compared to synchronized stochastic gradient descent.

Occlusion is a prevalent and easily realizable semantic perturbation to deep neural networks (DNNs). It can fool a DNN into misclassifying an input image by occluding some segments, possibly resulting in severe errors. Therefore, DNNs planted in safety-critical systems should be verified to be robust against occlusions prior to deployment. However, most existing robustness verification approaches for DNNs are focused on non-semantic perturbations and are not suited to the occlusion case. In this paper, we propose the first efficient, SMT-based approach for formally verifying the occlusion robustness of DNNs. We formulate the occlusion robustness verification problem and prove it is NP-complete. Then, we devise a novel approach for encoding occlusions as a part of neural networks and introduce two acceleration techniques so that the extended neural networks can be efficiently verified using off-the-shelf, SMT-based neural network verification tools. We implement our approach in a prototype called OccRob and extensively evaluate its performance on benchmark datasets with various occlusion variants. The experimental results demonstrate our approach's effectiveness and efficiency in verifying DNNs' robustness against various occlusions, and its ability to generate counterexamples when these DNNs are not robust.

Large models support great zero-shot and few-shot capabilities. However, updating these models on new tasks can break performance on previous seen tasks and their zero/few-shot unseen tasks. Our work explores how to update zero/few-shot learners such that they can maintain performance on seen/unseen tasks of previous tasks as well as new tasks. By manipulating the parameter updates of a gradient-based meta learner as the projected task-specific subnetworks, we show improvements for large models to retain seen and zero/few shot task performance in online settings.

Despite rapid advancements in lifelong learning (LLL) research, a large body of research mainly focuses on improving the performance in the existing \textit{static} continual learning (CL) setups. These methods lack the ability to succeed in a rapidly changing \textit{dynamic} environment, where an AI agent needs to quickly learn new instances in a `single pass' from the non-i.i.d (also possibly temporally contiguous/coherent) data streams without suffering from catastrophic forgetting. For practical applicability, we propose a novel lifelong learning approach, which is streaming, i.e., a single input sample arrives in each time step, single pass, class-incremental, and subject to be evaluated at any moment. To address this challenging setup and various evaluation protocols, we propose a Bayesian framework, that enables fast parameter update, given a single training example, and enables any-time inference. We additionally propose an implicit regularizer in the form of snap-shot self-distillation, which effectively minimizes the forgetting further. We further propose an effective method that efficiently selects a subset of samples for online memory rehearsal and employs a new replay buffer management scheme that significantly boosts the overall performance. Our empirical evaluations and ablations demonstrate that the proposed method outperforms the prior works by large margins.

Spatiotemporal learning, which aims at extracting spatiotemporal correlations from the collected spatiotemporal data, is a research hotspot in recent years. And considering the inherent graph structure of spatiotemporal data, recent works focus on capturing spatial dependencies by utilizing Graph Convolutional Networks (GCNs) to aggregate vertex features with the guidance of adjacency matrices. In this paper, with extensive and deep-going experiments, we comprehensively analyze existing spatiotemporal graph learning models and reveal that extracting adjacency matrices with carefully design strategies, which are viewed as the key of enhancing performance on graph learning, are largely ineffective. Meanwhile, based on these experiments, we also discover that the aggregation itself is more important than the way that how vertices are aggregated. With these preliminary, a novel efficient Graph-Free Spatial (GFS) learning module based on layer normalization for capturing spatial correlations in spatiotemporal graph learning. The proposed GFS module can be easily plugged into existing models for replacing all graph convolution components. Rigorous theoretical proof demonstrates that the time complexity of GFS is significantly better than that of graph convolution operation. Extensive experiments verify the superiority of GFS in both the perspectives of efficiency and learning effect in processing graph-structured data especially extreme large scale graph data.  ( 2 min )

In real-world data labeling applications, annotators often provide imperfect labels. It is thus common to employ multiple annotators to label data with some overlap between their examples. We study active learning in such settings, aiming to train an accurate classifier by collecting a dataset with the fewest total annotations. Here we propose ActiveLab, a practical method to decide what to label next that works with any classifier model and can be used in pool-based batch active learning with one or multiple annotators. ActiveLab automatically estimates when it is more informative to re-label examples vs. labeling entirely new ones. This is a key aspect of producing high quality labels and trained models within a limited annotation budget. In experiments on image and tabular data, ActiveLab reliably trains more accurate classifiers with far fewer annotations than a wide variety of popular active learning methods.

Fundamental differences between materials originate from the unique nature of their constituent chemical elements. Before specific differences emerge according to the precise ratios of elements in a given crystal structure, a material can be represented by the set of its constituent chemical elements. By working at the level of the periodic table, assessment of materials at the level of their phase fields reduces the combinatorial complexity to accelerate screening, and circumvents the challenges associated with composition-level approaches such as poor extrapolation within phase fields, and the impossibility of exhaustive sampling. This early stage discrimination combined with evaluation of novelty of phase fields aligns with the outstanding experimental challenge of identifying new areas of chemistry to investigate, by prioritising which elements to combine in a reaction. Here, we demonstrate that phase fields can be assessed with respect to the maximum expected value of a target functional property and ranked according to chemical novelty. We develop and present PhaseSelect, an end-to-end machine learning model that combines the representation, classification, regression and ranking of phase fields. First, PhaseSelect constructs elemental characteristics from the co-occurrence of chemical elements in computationally and experimentally reported materials, then it employs attention mechanisms to learn representation for phase fields and assess their functional performance. At the level of the periodic table, PhaseSelect quantifies the probability of observing a functional property, estimates its value within a phase field and also ranks a phase field novelty, which we demonstrate with significant accuracy for three avenues of materials applications for high-temperature superconductivity, high-temperature magnetism, and targeted bandgap energy.

The sustained growth of carbon emissions and global waste elicits significant sustainability concerns for our environment's future. The growing Internet of Things (IoT) has the potential to exacerbate this issue. However, an emerging area known as Tiny Machine Learning (TinyML) has the opportunity to help address these environmental challenges through sustainable computing practices. TinyML, the deployment of machine learning (ML) algorithms onto low-cost, low-power microcontroller systems, enables on-device sensor analytics that unlocks numerous always-on ML applications. This article discusses the potential of these TinyML applications to address critical sustainability challenges. Moreover, the footprint of this emerging technology is assessed through a complete life cycle analysis of TinyML systems. From this analysis, TinyML presents opportunities to offset its carbon emissions by enabling applications that reduce the emissions of other sectors. Nevertheless, when globally scaled, the carbon footprint of TinyML systems is not negligible, necessitating that designers factor in environmental impact when formulating new devices. Finally, research directions for enabling further opportunities for TinyML to contribute to a sustainable future are outlined.

Many deep learning applications benefit from using large models with billions of parameters. Training these models is notoriously expensive due to the need for specialized HPC clusters. In this work, we consider alternative setups for training large models: using cheap "preemptible" instances or pooling existing resources from multiple regions. We analyze the performance of existing model-parallel algorithms in these conditions and find configurations where training larger models becomes less communication-intensive. Based on these findings, we propose SWARM parallelism, a model-parallel training algorithm designed for poorly connected, heterogeneous and unreliable devices. SWARM creates temporary randomized pipelines between nodes that are rebalanced in case of failure. We empirically validate our findings and compare SWARM parallelism with existing large-scale training approaches. Finally, we combine our insights with compression strategies to train a large Transformer language model with 1B shared parameters (approximately 13B before sharing) on preemptible T4 GPUs with less than 200Mb/s network.

Large-scale AI systems that combine search and learning have reached super-human levels of performance in game-playing, but have also been shown to fail in surprising ways. The brittleness of such models limits their efficacy and trustworthiness in real-world deployments. In this work, we systematically study one such algorithm, AlphaZero, and identify two phenomena related to the nature of exploration. First, we find evidence of policy-value misalignment -- for many states, AlphaZero's policy and value predictions contradict each other, revealing a tension between accurate move-selection and value estimation in AlphaZero's objective. Further, we find inconsistency within AlphaZero's value function, which causes it to generalize poorly, despite its policy playing an optimal strategy. From these insights we derive VISA-VIS: a novel method that improves policy-value alignment and value robustness in AlphaZero. Experimentally, we show that our method reduces policy-value misalignment by up to 76%, reduces value generalization error by up to 50%, and reduces average value error by up to 55%.

Automatic modulation classification is a desired feature in many modern software-defined radios. In recent years, a number of convolutional deep learning architectures have been proposed for automatically classifying the modulation used on observed signal bursts. However, a comprehensive analysis of these differing architectures and importance of each design element has not been carried out. Thus it is unclear what tradeoffs the differing designs of these convolutional neural networks might have. In this research, we investigate numerous architectures for automatic modulation classification and perform a comprehensive ablation study to investigate the impacts of varying hyperparameters and design elements on automatic modulation classification performance. We show that a new state of the art in performance can be achieved using a subset of the studied design elements. In particular, we show that a combination of dilated convolutions, statistics pooling, and squeeze-and-excitation units results in the strongest performing classifier. We further investigate this best performer according to various other criteria, including short signal bursts, common misclassifications, and performance across differing modulation categories and modes.  ( 2 min )

Early stopping based on hold-out data is a popular regularization technique designed to mitigate overfitting and increase the predictive accuracy of neural networks. Models trained with early stopping often provide relatively accurate predictions, but they generally still lack precise statistical guarantees unless they are further calibrated using independent hold-out data. This paper addresses the above limitation with conformalized early stopping: a novel method that combines early stopping with conformal calibration while efficiently recycling the same hold-out data. This leads to models that are both accurate and able to provide exact predictive inferences without multiple data splits nor overly conservative adjustments. Practical implementations are developed for different learning tasks -- outlier detection, multi-class classification, regression -- and their competitive performance is demonstrated on real data.

We examine the problem of obtaining fair outcomes for individuals who choose to share optional information with machine-learned models and those who do not consent and keep their data undisclosed. We find that these non-consenting users receive significantly lower prediction outcomes than justified by their provided information alone. This observation gives rise to the overlooked problem of how to ensure that users, who protect their personal data, are not penalized. While statistical fairness notions focus on fair outcomes between advantaged and disadvantaged groups, these fairness notions fail to protect the non-consenting users. To address this problem, we formalize protection requirements for models which (i) allow users to benefit from sharing optional information and (ii) do not penalize them if they keep their data undisclosed. We offer the first solution to this problem by proposing the notion of Optional Feature Fairness (OFF), which we prove to be loss-optimal under our protection requirements (i) and (ii). To learn OFF-compliant models, we devise a model-agnostic data augmentation strategy with finite sample convergence guarantees. Finally, we extensively analyze OFF on a variety of challenging real-world tasks, models, and data sets with multiple optional features.

Machine learning (ML) models can underperform on certain population groups due to choices made during model development and bias inherent in the data. We categorize sources of discrimination in the ML pipeline into two classes: aleatoric discrimination, which is inherent in the data distribution, and epistemic discrimination, which is due to decisions during model development. We quantify aleatoric discrimination by determining the performance limits of a model under fairness constraints, assuming perfect knowledge of the data distribution. We demonstrate how to characterize aleatoric discrimination by applying Blackwell's results on comparing statistical experiments. We then quantify epistemic discrimination as the gap between a model's accuracy given fairness constraints and the limit posed by aleatoric discrimination. We apply this approach to benchmark existing interventions and investigate fairness risks in data with missing values. Our results indicate that state-of-the-art fairness interventions are effective at removing epistemic discrimination. However, when data has missing values, there is still significant room for improvement in handling aleatoric discrimination.  ( 2 min )

Supervised learning typically optimizes the expected value risk functional of the loss, but in many cases, we want to optimize for other risk functionals. In full-batch gradient descent, this is done by taking gradients of a risk functional of interest, such as the Conditional Value at Risk (CVaR) which ignores some quantile of extreme losses. However, deep learning must almost always use mini-batch gradient descent, and lack of unbiased estimators of various risk functionals make the right optimization procedure unclear. In this work, we introduce a meta-learning-based method of learning an interpretable mini-batch risk functional during model training, in a single shot. When optimizing for various risk functionals, the learned mini-batch risk functions lead to risk reduction of up to 10% over hand-engineered mini-batch risk functionals. Then in a setting where the right risk functional is unknown a priori, our method improves over baseline by 14% relative (~9% absolute). We analyze the learned mini-batch risk functionals at different points through training, and find that they learn a curriculum (including warm-up periods), and that their final form can be surprisingly different from the underlying risk functional that they optimize for.

Standard neural networks struggle to generalize under distribution shifts in computer vision. Fortunately, combining multiple networks can consistently improve out-of-distribution generalization. In particular, weight averaging (WA) strategies were shown to perform best on the competitive DomainBed benchmark; they directly average the weights of multiple networks despite their nonlinearities. In this paper, we propose Diverse Weight Averaging (DiWA), a new WA strategy whose main motivation is to increase the functional diversity across averaged models. To this end, DiWA averages weights obtained from several independent training runs: indeed, models obtained from different runs are more diverse than those collected along a single run thanks to differences in hyperparameters and training procedures. We motivate the need for diversity by a new bias-variance-covariance-locality decomposition of the expected error, exploiting similarities between WA and standard functional ensembling. Moreover, this decomposition highlights that WA succeeds when the variance term dominates, which we show occurs when the marginal distribution changes at test time. Experimentally, DiWA consistently improves the state of the art on DomainBed without inference overhead.

Self-Supervised Learning (SSL) methods operate on unlabeled data to learn robust representations useful for downstream tasks. Most SSL methods rely on augmentations obtained by transforming the 2D image pixel map. These augmentations ignore the fact that biological vision takes place in an immersive three-dimensional, temporally contiguous environment, and that low-level biological vision relies heavily on depth cues. Using a signal provided by a pretrained state-of-the-art monocular RGB-to-depth model (the \emph{Depth Prediction Transformer}, Ranftl et al., 2021), we explore two distinct approaches to incorporating depth signals into the SSL framework. First, we evaluate contrastive learning using an RGB+depth input representation. Second, we use the depth signal to generate novel views from slightly different camera positions, thereby producing a 3D augmentation for contrastive learning. We evaluate these two approaches on three different SSL methods -- BYOL, SimSiam, and SwAV -- using ImageNette (10 class subset of ImageNet), ImageNet-100 and ImageNet-1k datasets. We find that both approaches to incorporating depth signals improve the robustness and generalization of the baseline SSL methods, though the first approach (with depth-channel concatenation) is superior. For instance, BYOL with the additional depth channel leads to an increase in downstream classification accuracy from 85.3\% to 88.0\% on ImageNette and 84.1\% to 87.0\% on ImageNet-C.

We propose a Gaussian manifold variational auto-encoder (GM-VAE) whose latent space consists of a set of Gaussian distributions. It is known that the set of the univariate Gaussian distributions with the Fisher information metric form a hyperbolic space, which we call a Gaussian manifold. To learn the VAE endowed with the Gaussian manifolds, we propose a pseudo-Gaussian manifold normal distribution based on the Kullback-Leibler divergence, a local approximation of the squared Fisher-Rao distance, to define a density over the latent space. In experiments, we demonstrate the efficacy of GM-VAE on two different tasks: density estimation of image datasets and environment modeling in model-based reinforcement learning. GM-VAE outperforms the other variants of hyperbolic- and Euclidean-VAEs on density estimation tasks and shows competitive performance in model-based reinforcement learning. We observe that our model provides strong numerical stability, addressing a common limitation reported in previous hyperbolic-VAEs.

Bayesian model comparison (BMC) offers a principled approach for assessing the relative merits of competing computational models and propagating uncertainty into model selection decisions. However, BMC is often intractable for the popular class of hierarchical models due to their high-dimensional nested parameter structure. To address this intractability, we propose a deep learning method for performing BMC on any set of hierarchical models which can be instantiated as probabilistic programs. Since our method enables amortized inference, it allows efficient re-estimation of posterior model probabilities and fast performance validation prior to any real-data application. In a series of extensive validation studies, we benchmark the performance of our method against the state-of-the-art bridge sampling method and demonstrate excellent amortized inference across all BMC settings. We then use our method to compare four hierarchical evidence accumulation models that have previously been deemed intractable for BMC due to partly implicit likelihoods. In this application, we corroborate evidence for the recently proposed L\'evy flight model of decision-making and show how transfer learning can be leveraged to enhance training efficiency. Reproducible code for all analyses is provided.

In the sequential decision making setting, an agent aims to achieve systematic generalization over a large, possibly infinite, set of environments. Such environments are modeled as discrete Markov decision processes with both states and actions represented through a feature vector. The underlying structure of the environments allows the transition dynamics to be factored into two components: one that is environment-specific and another that is shared. Consider a set of environments that share the laws of motion as an example. In this setting, the agent can take a finite amount of reward-free interactions from a subset of these environments. The agent then must be able to approximately solve any planning task defined over any environment in the original set, relying on the above interactions only. Can we design a provably efficient algorithm that achieves this ambitious goal of systematic generalization? In this paper, we give a partially positive answer to this question. First, we provide a tractable formulation of systematic generalization by employing a causal viewpoint. Then, under specific structural assumptions, we provide a simple learning algorithm that guarantees any desired planning error up to an unavoidable sub-optimality term, while showcasing a polynomial sample complexity.

The rapid development of diagnostic technologies in healthcare is leading to higher requirements for physicians to handle and integrate the heterogeneous, yet complementary data that are produced during routine practice. For instance, the personalized diagnosis and treatment planning for a single cancer patient relies on the various images (e.g., radiological, pathological, and camera images) and non-image data (e.g., clinical data and genomic data). However, such decision-making procedures can be subjective, qualitative, and have large inter-subject variabilities. With the recent advances in multi-modal deep learning technologies, an increasingly large number of efforts have been devoted to a key question: how do we extract and aggregate multi-modal information to ultimately provide more objective, quantitative computer-aided clinical decision making? This paper reviews the recent studies on dealing with such a question. Briefly, this review will include the (1) overview of current multi-modal learning workflows, (2) summarization of multi-modal fusion methods, (3) discussion of the performance, (4) applications in disease diagnosis and prognosis, and (5) challenges and future directions.

We study constrained clustering, where constraints guide the clustering process. In existing works, two categories of constraints have been widely explored, namely pairwise and cardinality constraints. Pairwise constraints enforce the cluster labels of two instances to be the same (must-link constraints) or different (cannot-link constraints). Cardinality constraints encourage cluster sizes to satisfy a user-specified distribution. Most existing constrained clustering models can only utilize one category of constraints at a time. We enforce the above two categories into a unified clustering model starting with the integer program formulation of the standard K-means. As the two categories provide different useful information, utilizing both allow for better clustering performance. However, the optimization is difficult due to the binary and quadratic constraints in the unified formulation. To solve this, we utilize two techniques: equivalently replacing the binary constraints by the intersection of two continuous constraints; the other is transforming the quadratic constraints into bi-linear constraints by introducing extra variables. We derive an equivalent continuous reformulation with simple constraints, which can be efficiently solved by Alternating Direction Method of Multipliers. Extensive experiments on both synthetic and real data demonstrate when: (1) utilizing a single category of constraint, the proposed model is superior to or competitive with SOTA constrained clustering models, and (2) utilizing both categories of constraints jointly, the proposed model shows better performance than the case of the single category. The experiments show that the proposed method exploits the constraints to achieve perfect clustering performance with improved clustering to 2%-5% in classical clustering metrics, e.g. Adjusted Random, Mirkin's, and Huber's, indices outerperfomring other methods.

Conventional survival analysis methods are typically ineffective to characterize heterogeneity in the population while such information can be used to assist predictive modeling. In this study, we propose a hybrid survival analysis method, referred to as deep clustering survival machines, that combines the discriminative and generative mechanisms. Similar to the mixture models, we assume that the timing information of survival data is generatively described by a mixture of certain numbers of parametric distributions, i.e., expert distributions. We learn weights of the expert distributions for individual instances according to their features discriminatively such that each instance's survival information can be characterized by a weighted combination of the learned constant expert distributions. This method also facilitates interpretable subgrouping/clustering of all instances according to their associated expert distributions. Extensive experiments on both real and synthetic datasets have demonstrated that the method is capable of obtaining promising clustering results and competitive time-to-event predicting performance.

In order for agents in multi-agent systems (MAS) to be safe, they need to take into account the risks posed by the actions of other agents. However, the dominant paradigm in game theory (GT) assumes that agents are not affected by risk from other agents and only strive to maximise their expected utility. For example, in hybrid human-AI driving systems, it is necessary to limit large deviations in reward resulting from car crashes. Although there are equilibrium concepts in game theory that take into account risk aversion, they either assume that agents are risk-neutral with respect to the uncertainty caused by the actions of other agents, or they are not guaranteed to exist. We introduce a new GT-based Risk-Averse Equilibrium (RAE) that always produces a solution that minimises the potential variance in reward accounting for the strategy of other agents. Theoretically and empirically, we show RAE shares many properties with a Nash Equilibrium (NE), establishing convergence properties and generalising to risk-dominant NE in certain cases. To tackle large-scale problems, we extend RAE to the PSRO multi-agent reinforcement learning (MARL) framework. We empirically demonstrate the minimum reward variance benefits of RAE in matrix games with high-risk outcomes. Results on MARL experiments show RAE generalises to risk-dominant NE in a trust dilemma game and that it reduces instances of crashing by 7x in an autonomous driving setting versus the best performing baseline.

We propose a continuous optimization framework for discovering a latent directed acyclic graph (DAG) from observational data. Our approach optimizes over the polytope of permutation vectors, the so-called Permutahedron, to learn a topological ordering. Edges can be optimized jointly, or learned conditional on the ordering via a non-differentiable subroutine. Compared to existing continuous optimization approaches our formulation has a number of advantages including: 1. validity: optimizes over exact DAGs as opposed to other relaxations optimizing approximate DAGs; 2. modularity: accommodates any edge-optimization procedure, edge structural parameterization, and optimization loss; 3. end-to-end: either alternately iterates between node-ordering and edge-optimization, or optimizes them jointly. We demonstrate, on real-world data problems in protein-signaling and transcriptional network discovery, that our approach lies on the Pareto frontier of two key metrics, the SID and SHD.

Under losses which are potentially heavy-tailed, we consider the task of minimizing sums of the loss mean and standard deviation, without trying to accurately estimate the variance. By modifying a technique for variance-free robust mean estimation to fit our problem setting, we derive a simple learning procedure which can be easily combined with standard gradient-based solvers to be used in traditional machine learning workflows. Empirically, we verify that our proposed approach, despite its simplicity, performs as well or better than even the best-performing candidates derived from alternative criteria such as CVaR or DRO risks on a variety of datasets.  ( 2 min )

Human visual perception can easily generalize to out-of-distributed visual data, which is far beyond the capability of modern machine learning models. Domain generalization (DG) aims to close this gap, with existing DG methods mainly focusing on the loss function design. In this paper, we propose to explore an orthogonal direction, i.e., the design of the backbone architecture. It is motivated by an empirical finding that transformer-based models trained with empirical risk minimization (ERM) outperform CNN-based models employing state-of-the-art (SOTA) DG algorithms on multiple DG datasets. We develop a formal framework to characterize a network's robustness to distribution shifts by studying its architecture's alignment with the correlations in the dataset. This analysis guides us to propose a novel DG model built upon vision transformers, namely Generalizable Mixture-of-Experts (GMoE). Extensive experiments on DomainBed demonstrate that GMoE trained with ERM outperforms SOTA DG baselines by a large margin. Moreover, GMoE is complementary to existing DG methods and its performance is substantially improved when trained with DG algorithms.

Neural networks are vulnerable to backdoor poisoning attacks, where the attackers maliciously poison the training set and insert triggers into the test input to change the prediction of the victim model. Existing defenses for backdoor attacks either provide no formal guarantees or come with expensive-to-compute and ineffective probabilistic guarantees. We present PECAN, an efficient and certified approach for defending against backdoor attacks. The key insight powering PECAN is to apply off-the-shelf test-time evasion certification techniques on a set of neural networks trained on disjoint partitions of the data. We evaluate PECAN on image classification and malware detection datasets. Our results demonstrate that PECAN can (1) significantly outperform the state-of-the-art certified backdoor defense, both in defense strength and efficiency, and (2) on real back-door attacks, PECAN can reduce attack success rate by order of magnitude when compared to a range of baselines from the literature.

In this paper, we aimed to help bridge the gap between human fluid intelligence - the ability to solve novel tasks without prior training - and the performance of deep neural networks, which typically require extensive prior training. An essential cognitive component for solving intelligence tests, which in humans are used to measure fluid intelligence, is the ability to identify regularities in sequences. This motivated us to construct a benchmark task, which we term \textit{sequence consistency evaluation} (SCE), whose solution requires the ability to identify regularities in sequences. Given the proven capabilities of deep networks, their ability to solve such tasks after extensive training is expected. Surprisingly, however, we show that naive (randomly initialized) deep learning models that are trained on a \textit{single} SCE with a \textit{single} optimization step can still solve non-trivial versions of the task relatively well. We extend our findings to solve, without any prior training, real-world anomaly detection tasks in the visual and auditory modalities. These results demonstrate the fluid-intelligent computational capabilities of deep networks. We discuss the implications of our work for constructing fluid-intelligent machines.

Bi-stochastic normalization provides an alternative normalization of graph Laplacians in graph-based data analysis and can be computed efficiently by Sinkhorn-Knopp (SK) iterations. This paper proves the convergence of bi-stochastically normalized graph Laplacian to manifold (weighted-)Laplacian with rates, when $n$ data points are i.i.d. sampled from a general $d$-dimensional manifold embedded in a possibly high-dimensional space. Under certain joint limit of $n \to \infty$ and kernel bandwidth $\epsilon \to 0$, the point-wise convergence rate of the graph Laplacian operator (under 2-norm) is proved to be $ O( n^{-1/(d/2+3)})$ at finite large $n$ up to log factors, achieved at the scaling of $\epsilon \sim n^{-1/(d/2+3)} $. When the manifold data are corrupted by outlier noise, we theoretically prove the graph Laplacian point-wise consistency which matches the rate for clean manifold data plus an additional term proportional to the boundedness of the inner-products of the noise vectors among themselves and with data vectors. Motivated by our analysis, which suggests that not exact bi-stochastic normalization but an approximate one will achieve the same consistency rate, we propose an approximate and constrained matrix scaling problem that can be solved by SK iterations with early termination. Numerical experiments support our theoretical results and show the robustness of bi-stochastically normalized graph Laplacian to high-dimensional outlier noise.

Recent advances in data-generating techniques led to an explosive growth of geo-spatiotemporal data. In domains such as hydrology, ecology, and transportation, interpreting the complex underlying patterns of spatiotemporal interactions with the help of deep learning techniques hence becomes the need of the hour. However, applying deep learning techniques without domain-specific knowledge tends to provide sub-optimal prediction performance. Secondly, training such models on large-scale data requires extensive computational resources. To eliminate these challenges, we present a novel distributed domain-aware spatiotemporal network that utilizes domain-specific knowledge with improved model performance. Our network consists of a pixel-contribution block, a distributed multiheaded multichannel convolutional (CNN) spatial block, and a recurrent temporal block. We choose flood prediction in hydrology as a use case to test our proposed method. From our analysis, the network effectively predicts high peaks in discharge measurements at watershed outlets with up to 4.1x speedup and increased prediction performance of up to 93\%. Our approach achieved a 12.6x overall speedup and increased the mean prediction performance by 16\%. We perform extensive experiments on a dataset of 23 watersheds in a northern state of the U.S. and present our findings.

We study the error of linear regression in the face of adversarial attacks. In this framework, an adversary changes the input to the regression model in order to maximize the prediction error. We provide bounds on the prediction error in the presence of an adversary as a function of the parameter norm and the error in the absence of such an adversary. We show how these bounds make it possible to study the adversarial error using analysis from non-adversarial setups. The obtained results shed light on the robustness of overparameterized linear models to adversarial attacks. Adding features might be either a source of additional robustness or brittleness. On the one hand, we use asymptotic results to illustrate how double-descent curves can be obtained for the adversarial error. On the other hand, we derive conditions under which the adversarial error can grow to infinity as more features are added, while at the same time, the test error goes to zero. We show this behavior is caused by the fact that the norm of the parameter vector grows with the number of features. It is also established that $\ell_\infty$ and $\ell_2$-adversarial attacks might behave fundamentally differently due to how the $\ell_1$ and $\ell_2$-norms of random projections concentrate. We also show how our reformulation allows for solving adversarial training as a convex optimization problem. This fact is then exploited to establish similarities between adversarial training and parameter-shrinking methods and to study how the training might affect the robustness of the estimated models.

In machine learning, fewer features reduce model complexity. Carefully assessing the influence of each input feature on the model quality is therefore a crucial preprocessing step. We propose a novel feature selection algorithm based on a quadratic unconstrained binary optimization (QUBO) problem, which allows to select a specified number of features based on their importance and redundancy. In contrast to iterative or greedy methods, our direct approach yields higherquality solutions. QUBO problems are particularly interesting because they can be solved on quantum hardware. To evaluate our proposed algorithm, we conduct a series of numerical experiments using a classical computer, a quantum gate computer and a quantum annealer. Our evaluation compares our method to a range of standard methods on various benchmark datasets. We observe competitive performance.  ( 2 min )

Deep neural networks are becoming increasingly popular in approximating arbitrary functions from noisy data. But wider adoption is being hindered by the need to explain such models and to impose additional constraints on them. Monotonicity constraint is one of the most requested properties in real-world scenarios and is the focus of this paper. One of the oldest ways to construct a monotonic fully connected neural network is to constrain its weights to be non-negative while employing a monotonic activation function. Unfortunately, this construction does not work with popular non-saturated activation functions such as ReLU, ELU, SELU etc, as it can only approximate convex functions. We show this shortcoming can be fixed by employing the original activation function for a part of the neurons in the layer, and employing its point reflection for the other part. Our experiments show this approach of building monotonic deep neural networks have matching or better accuracy when compared to other state-of-the-art methods such as deep lattice networks or monotonic networks obtained by heuristic regularization. This method is the simplest one in the sense of having the least number of parameters, not requiring any modifications to the learning procedure or steps post-learning steps.

Variational autoencoders (VAEs) are a popular framework for modeling complex data distributions; they can be efficiently trained via variational inference by maximizing the evidence lower bound (ELBO), at the expense of a gap to the exact (log-)marginal likelihood. While VAEs are commonly used for representation learning, it is unclear why ELBO maximization would yield useful representations, since unregularized maximum likelihood estimation cannot invert the data-generating process. Yet, VAEs often succeed at this task. We seek to elucidate this apparent paradox by studying nonlinear VAEs in the limit of near-deterministic decoders. We first prove that, in this regime, the optimal encoder approximately inverts the decoder -- a commonly used but unproven conjecture -- which we refer to as {\em self-consistency}. Leveraging self-consistency, we show that the ELBO converges to a regularized log-likelihood. This allows VAEs to perform what has recently been termed independent mechanism analysis (IMA): it adds an inductive bias towards decoders with column-orthogonal Jacobians, which helps recovering the true latent factors. The gap between ELBO and log-likelihood is therefore welcome, since it bears unanticipated benefits for nonlinear representation learning. In experiments on synthetic and image data, we show that VAEs uncover the true latent factors when the data generating process satisfies the IMA assumption.

Batch Bayesian optimisation (BO) has shown to be a sample-efficient method of performing optimisation where expensive-to-evaluate objective functions can be queried in parallel. However, current methods do not scale to large batch sizes -- a frequent desideratum in practice (e.g. drug discovery or simulation-based inference). We present a novel algorithm, SOBER, which permits scalable and diversified batch BO with arbitrary acquisition functions, arbitrary input spaces (e.g. graph), and arbitrary kernels. The key to our approach is to reformulate batch selection for BO as a Bayesian quadrature (BQ) problem, which offers computational advantages. This reformulation is beneficial in solving BQ tasks reciprocally, which introduces the exploitative functionality of BO to BQ. We show that SOBER offers substantive performance gains in synthetic and real-world tasks, including drug discovery and simulation-based inference.

This paper presents a stochastic differential equation (SDE) approach for general-purpose image restoration. The key construction consists in a mean-reverting SDE that transforms a high-quality image into a degraded counterpart as a mean state with fixed Gaussian noise. Then, by simulating the corresponding reverse-time SDE, we are able to restore the origin of the low-quality image without relying on any task-specific prior knowledge. Crucially, the proposed mean-reverting SDE has a closed-form solution, allowing us to compute the ground truth time-dependent score and learn it with a neural network. Moreover, we propose a maximum likelihood objective to learn an optimal reverse trajectory which stabilizes the training and improves the restoration results. In the experiments, we show that our proposed method achieves highly competitive performance in quantitative comparisons on image deraining, deblurring, and denoising, setting a new state-of-the-art on two deraining datasets. Finally, the general applicability of our approach is further demonstrated via qualitative results on image super-resolution, inpainting, and dehazing. Code is available at \url{https://github.com/Algolzw/image-restoration-sde}.

Identifying a small molecule from its mass spectrum is the primary open problem in computational metabolomics. This is typically cast as information retrieval: an unknown spectrum is matched against spectra predicted computationally from a large database of chemical structures. However, current approaches to spectrum prediction model the output space in ways that force a tradeoff between capturing high resolution mass information and tractable learning. We resolve this tradeoff by casting spectrum prediction as a mapping from an input molecular graph to a probability distribution over molecular formulas. We discover that a large corpus of mass spectra can be closely approximated using a fixed vocabulary constituting only 2% of all observed formulas. This enables efficient spectrum prediction using an architecture similar to graph classification - GrAFF-MS - achieving significantly lower prediction error and orders-of-magnitude faster runtime than state-of-the-art methods.

Advances in machine learning have enabled the prediction of immune system responses to prophylactic and therapeutic vaccines. However, the engineering task of designing vaccines remains a challenge. In particular, the genetic variability of the human immune system makes it difficult to design peptide vaccines that provide widespread immunity in vaccinated populations. We introduce a framework for evaluating and designing peptide vaccines that uses probabilistic machine learning models, and demonstrate its ability to produce designs for a SARS-CoV-2 vaccine that outperform previous designs. We provide a theoretical analysis of the approximability, scalability, and complexity of our framework.

The exploration/exploitation trade-off is an inherent challenge in data-driven adaptive control. Though this trade-off has been studied for multi-armed bandits (MAB's) and reinforcement learning for linear systems; it is less well-studied for learning-based control of nonlinear systems. A significant theoretical challenge in the nonlinear setting is that there is no explicit characterization of an optimal controller for a given set of cost and system parameters. We propose the use of a finite-horizon oracle controller with full knowledge of parameters as a reasonable surrogate to optimal controller. This allows us to develop policies in the context of learning-based MPC and MAB's and conduct a control-theoretic analysis using techniques from MPC- and optimization-theory to show these policies achieve low regret with respect to this finite-horizon oracle. Our simulations exhibit the low regret of our policy on a heating, ventilation, and air-conditioning model with partially-unknown cost function.  ( 2 min )

To provide rigorous uncertainty quantification for online learning models, we develop a framework for constructing uncertainty sets that provably control risk -- such as coverage of confidence intervals, false negative rate, or F1 score -- in the online setting. This extends conformal prediction to apply to a larger class of online learning problems. Our method guarantees risk control at any user-specified level even when the underlying data distribution shifts drastically, even adversarially, over time in an unknown fashion. The technique we propose is highly flexible as it can be applied with any base online learning algorithm (e.g., a deep neural network trained online), requiring minimal implementation effort and essentially zero additional computational cost. We further extend our approach to control multiple risks simultaneously, so the prediction sets we generate are valid for all given risks. To demonstrate the utility of our method, we conduct experiments on real-world tabular time-series data sets showing that the proposed method rigorously controls various natural risks. Furthermore, we show how to construct valid intervals for an online image-depth estimation problem that previous sequential calibration schemes cannot handle.

Constrained Markov decision processes (CMDPs) model scenarios of sequential decision making with multiple objectives that are increasingly important in many applications. However, the model is often unknown and must be learned online while still ensuring the constraint is met, or at least the violation is bounded with time. Some recent papers have made progress on this very challenging problem but either need unsatisfactory assumptions such as knowledge of a safe policy, or have high cumulative regret. We propose the Safe PSRL (posterior sampling-based RL) algorithm that does not need such assumptions and yet performs very well, both in terms of theoretical regret bounds as well as empirically. The algorithm achieves an efficient tradeoff between exploration and exploitation by use of the posterior sampling principle, and provably suffers only bounded constraint violation by leveraging the idea of pessimism. Our approach is based on a primal-dual approach. We establish a sub-linear $\tilde{\mathcal{ O}}\left(H^{2.5} \sqrt{|\mathcal{S}|^2 |\mathcal{A}| K} \right)$ upper bound on the Bayesian reward objective regret along with a bounded, i.e., $\tilde{\mathcal{O}}\left(1\right)$ constraint violation regret over $K$ episodes for an $|\mathcal{S}|$-state, $|\mathcal{A}|$-action and horizon $H$ CMDP.  ( 2 min )

Real-world deep learning models developed for Time Series Forecasting are used in several critical applications ranging from medical devices to the security domain. Many previous works have shown how deep learning models are prone to adversarial attacks and studied their vulnerabilities. However, the vulnerabilities of time series models for forecasting due to adversarial inputs are not extensively explored. While the attack on a forecasting model might aim to deteriorate the performance of the model, it is more effective, if the attack is focused on a specific impact on the model's output. In this paper, we propose a novel formulation of Directional, Amplitudinal, and Temporal targeted adversarial attacks on time series forecasting models. These targeted attacks create a specific impact on the amplitude and direction of the output prediction. We use the existing adversarial attack techniques from the computer vision domain and adapt them for time series. Additionally, we propose a modified version of the Auto Projected Gradient Descent attack for targeted attacks. We examine the impact of the proposed targeted attacks versus untargeted attacks. We use KS-Tests to statistically demonstrate the impact of the attack. Our experimental results show how targeted attacks on time series models are viable and are more powerful in terms of statistical similarity. It is, hence difficult to detect through statistical methods. We believe that this work opens a new paradigm in the time series forecasting domain and represents an important consideration for developing better defenses.  ( 2 min )

We consider a decentralized multiplayer game, played over $T$ rounds, with a leader-follower hierarchy described by a directed acyclic graph. For each round, the graph structure dictates the order of the players and how players observe the actions of one another. By the end of each round, all players receive a joint bandit-reward based on their joint action that is used to update the player strategies towards the goal of minimizing the joint pseudo-regret. We present a learning algorithm inspired by the single-player multi-armed bandit problem and show that it achieves sub-linear joint pseudo-regret in the number of rounds for both adversarial and stochastic bandit rewards. Furthermore, we quantify the cost incurred due to the decentralized nature of our problem compared to the centralized setting.

Warning: this paper contains content that may be offensive or upsetting. In the current context where online platforms have been effectively weaponized in a variety of geo-political events and social issues, Internet memes make fair content moderation at scale even more difficult. Existing work on meme classification and tracking has focused on black-box methods that do not explicitly consider the semantics of the memes or the context of their creation. In this paper, we pursue a modular and explainable architecture for Internet meme understanding. We design and implement multimodal classification methods that perform example- and prototype-based reasoning over training cases, while leveraging both textual and visual SOTA models to represent the individual cases. We study the relevance of our modular and explainable models in detecting harmful memes on two existing tasks: Hate Speech Detection and Misogyny Classification. We compare the performance between example- and prototype-based methods, and between text, vision, and multimodal models, across different categories of harmfulness (e.g., stereotype and objectification). We devise a user-friendly interface that facilitates the comparative analysis of examples retrieved by all of our models for any given meme, informing the community about the strengths and limitations of these explainable methods.  ( 2 min )

Neural networks are notoriously vulnerable to adversarial attacks -- small imperceptible perturbations that can change the network's output drastically. In the reverse direction, there may exist large, meaningful perturbations that leave the network's decision unchanged (excessive invariance, nonivertibility). We study the latter phenomenon in two contexts: (a) discrete-time dynamical system identification, as well as (b) calibration of the output of one neural network to the output of another (neural network matching). For ReLU networks and $L_p$ norms ($p=1,2,\infty$), we formulate these optimization problems as mixed-integer programs (MIPs) that apply to neural network approximators of dynamical systems. We also discuss the applicability of our results to invertibility certification in transformations between neural networks (e.g. at different levels of pruning).

Most personalised federated learning (FL) approaches assume that raw data of all clients are defined in a common subspace i.e. all clients store their data according to the same schema. For real-world applications, this assumption is restrictive as clients, having their own systems to collect and then store data, may use heterogeneous data representations. We aim at filling this gap. To this end, we propose a general framework coined FLIC that maps client's data onto a common feature space via local embedding functions. The common feature space is learnt in a federated manner using Wasserstein barycenters while the local embedding functions are trained on each client via distribution alignment. We integrate this distribution alignement mechanism into a federated learning approach and provide the algorithmics of FLIC. We compare its performances against FL benchmarks involving heterogeneous input features spaces. In addition, we provide theoretical insights supporting the relevance of our methodology.  ( 2 min )

In this study, we address the problem of optimizing multi-output black-box functions under uncertain environments. We formulate this problem as the estimation of the uncertain Pareto-frontier (PF) of a multi-output Bayesian surrogate model with two types of variables: design variables and environmental variables. We consider this problem within the context of Bayesian optimization (BO) under uncertain environments, where the design variables are controllable, whereas the environmental variables are assumed to be random and not controllable. The challenge of this problem is to robustly estimate the PF when the distribution of the environmental variables is unknown, that is, to estimate the PF when the environmental variables are generated from the worst possible distribution. We propose a method for solving the BO problem by appropriately incorporating the uncertainties of the environmental variables and their probability distribution. We demonstrate that the proposed method can find an arbitrarily accurate PF with high probability in a finite number of iterations. We also evaluate the performance of the proposed method through numerical experiments.  ( 2 min )

How to do big portfolio selection is very important but challenging for both researchers and practitioners. In this paper, we propose a new graph-based conditional moments (GRACE) method to do portfolio selection based on thousands of stocks or more. The GRACE method first learns the conditional quantiles and mean of stock returns via a factor-augmented temporal graph convolutional network, which guides the learning procedure through a factor-hypergraph built by the set of stock-to-stock relations from the domain knowledge as well as the set of factor-to-stock relations from the asset pricing knowledge. Next, the GRACE method learns the conditional variance, skewness, and kurtosis of stock returns from the learned conditional quantiles by using the quantiled conditional moment (QCM) method. The QCM method is a supervised learning procedure to learn these conditional higher-order moments, so it largely overcomes the computational difficulty from the classical high-dimensional GARCH-type methods. Moreover, the QCM method allows the mis-specification in modeling conditional quantiles to some extent, due to its regression-based nature. Finally, the GRACE method uses the learned conditional mean, variance, skewness, and kurtosis to construct several performance measures, which are criteria to sort the stocks to proceed the portfolio selection in the well-known 10-decile framework. An application to NASDAQ and NYSE stock markets shows that the GRACE method performs much better than its competitors, particularly when the performance measures are comprised of conditional variance, skewness, and kurtosis.

In this paper, we study the collaborative learning model, which concerns the tradeoff between parallelism and communication overhead in multi-agent reinforcement learning. For a fundamental problem in bandit theory, regret minimization in multi-armed bandits, we present the first and almost tight tradeoffs between the number of rounds of communication between the agents and the regret of the collaborative learning process.  ( 2 min )

Many policy optimization approaches in reinforcement learning incorporate a Kullback-Leilbler (KL) divergence to the previous policy, to prevent the policy from changing too quickly. This idea was initially proposed in a seminal paper on Conservative Policy Iteration, with approximations given by algorithms like TRPO and Munchausen Value Iteration (MVI). We continue this line of work by investigating a generalized KL divergence -- called the Tsallis KL divergence -- which use the $q$-logarithm in the definition. The approach is a strict generalization, as $q = 1$ corresponds to the standard KL divergence; $q > 1$ provides a range of new options. We characterize the types of policies learned under the Tsallis KL, and motivate when $q >1$ could be beneficial. To obtain a practical algorithm that incorporates Tsallis KL regularization, we extend MVI, which is one of the simplest approaches to incorporate KL regularization. We show that this generalized MVI($q$) obtains significant improvements over the standard MVI($q = 1$) across 35 Atari games.

We present a novel method for the safety verification of nonlinear dynamical models that uses neural networks to represent abstractions of their dynamics. Neural networks have extensively been used before as approximators; in this work, we make a step further and use them for the first time as abstractions. For a given dynamical model, our method synthesises a neural network that overapproximates its dynamics by ensuring an arbitrarily tight, formally certified bound on the approximation error. For this purpose, we employ a counterexample-guided inductive synthesis procedure. We show that this produces a neural ODE with non-deterministic disturbances that constitutes a formal abstraction of the concrete model under analysis. This guarantees a fundamental property: if the abstract model is safe, i.e., free from any initialised trajectory that reaches an undesirable state, then the concrete model is also safe. By using neural ODEs with ReLU activation functions as abstractions, we cast the safety verification problem for nonlinear dynamical models into that of hybrid automata with affine dynamics, which we verify using SpaceEx. We demonstrate that our approach performs comparably to the mature tool Flow* on existing benchmark nonlinear models. We additionally demonstrate and that it is effective on models that do not exhibit local Lipschitz continuity, which are out of reach to the existing technologies.

Efficient video-language modeling should consider the computational cost because of a large, sometimes intractable, number of video frames. Parametric approaches such as the attention mechanism may not be ideal since its computational cost quadratically increases as the video length increases. Rather, previous studies have relied on offline feature extraction or frame sampling to represent the video efficiently, focusing on cross-modal modeling in short video clips. In this paper, we propose a semi-parametric video-grounded text generation model, SeViT, a novel perspective on scalable video-language modeling toward long untrimmed videos. Treating a video as an external data store, SeViT includes a non-parametric frame retriever to select a few query-relevant frames from the data store for a given query and a parametric generator to effectively aggregate the frames with the query via late fusion methods. Experimental results demonstrate our method has a significant advantage in longer videos and causal video understanding. Moreover, our model achieves the new state of the art on four video-language datasets, iVQA (+4.8), Next-QA (+6.9), and Activitynet-QA (+4.8) in accuracy, and MSRVTT-Caption (+3.6) in CIDEr.

As a framework for sequential decision-making, Reinforcement Learning (RL) has been regarded as an essential component leading to Artificial General Intelligence (AGI). However, RL is often criticized for having the same training environment as the test one, which also hinders its application in the real world. To mitigate this problem, Distributionally Robust RL (DRRL) is proposed to improve the worst performance in a set of environments that may contain the unknown test environment. Due to the nonlinearity of the robustness goal, most of the previous work resort to the model-based approach, learning with either an empirical distribution learned from the data or a simulator that can be sampled infinitely, which limits their applications in simple dynamics environments. In contrast, we attempt to design a DRRL algorithm that can be trained along a single trajectory, i.e., no repeated sampling from a state. Based on the standard Q-learning, we propose distributionally robust Q-learning with the single trajectory (DRQ) and its average-reward variant named differential DRQ. We provide asymptotic convergence guarantees and experiments for both settings, demonstrating their superiority in the perturbed environments against the non-robust ones.

Current reinforcement learning (RL) often suffers when solving a challenging exploration problem where the desired outcomes or high rewards are rarely observed. Even though curriculum RL, a framework that solves complex tasks by proposing a sequence of surrogate tasks, shows reasonable results, most of the previous works still have difficulty in proposing curriculum due to the absence of a mechanism for obtaining calibrated guidance to the desired outcome state without any prior domain knowledge. To alleviate it, we propose an uncertainty & temporal distance-aware curriculum goal generation method for the outcome-directed RL via solving a bipartite matching problem. It could not only provide precisely calibrated guidance of the curriculum to the desired outcome states but also bring much better sample efficiency and geometry-agnostic curriculum goal proposal capability compared to previous curriculum RL methods. We demonstrate that our algorithm significantly outperforms these prior methods in a variety of challenging navigation tasks and robotic manipulation tasks in a quantitative and qualitative way.

In this paper we describe the mathematical foundations of a new approach to semi-supervised Machine Learning. Using techniques of Symbolic Computation and Computer Algebra, we apply the concept of persistent homology to obtain a new semi-supervised learning method.

Understanding the interaction between different road users is critical for road safety and automated vehicles (AVs). Existing mathematical models on this topic have been proposed based mostly on either cognitive or machine learning (ML) approaches. However, current cognitive models are incapable of simulating road user trajectories in general scenarios, and ML models lack a focus on the mechanisms generating the behavior and take a high-level perspective which can cause failures to capture important human-like behaviors. Here, we develop a model of human pedestrian crossing decisions based on computational rationality, an approach using deep reinforcement learning (RL) to learn boundedly optimal behavior policies given human constraints, in our case a model of the limited human visual system. We show that the proposed combined cognitive-RL model captures human-like patterns of gap acceptance and crossing initiation time. Interestingly, our model's decisions are sensitive to not only the time gap, but also the speed of the approaching vehicle, something which has been described as a "bias" in human gap acceptance behavior. However, our results suggest that this is instead a rational adaption to human perceptual limitations. Moreover, we demonstrate an approach to accounting for individual differences in computational rationality models, by conditioning the RL policy on the parameters of the human constraints. Our results demonstrate the feasibility of generating more human-like road user behavior by combining RL with cognitive models.

Loss functions serve as the foundation of supervised learning and are often chosen prior to model development. To avoid potentially ad hoc choices of losses, statistical decision theory describes a desirable property for losses known as \emph{properness}, which asserts that Bayes' rule is optimal. Recent works have sought to \emph{learn losses} and models jointly. Existing methods do this by fitting an inverse canonical link function which monotonically maps $\mathbb{R}$ to $[0,1]$ to estimate probabilities for binary problems. In this paper, we extend monotonicity to maps between $\mathbb{R}^{C-1}$ and the projected probability simplex $\tilde{\Delta}^{C-1}$ by using monotonicity of gradients of convex functions. We present {\sc LegendreTron} as a novel and practical method that jointly learns \emph{proper canonical losses} and probabilities for multiclass problems. Tested on a benchmark of domains with up to 1,000 classes, our experimental results show that our method consistently outperforms the natural multiclass baseline under a $t$-test at 99% significance on all datasets with greater than 10 classes.

This thesis considers sequential decision problems, where the loss/reward incurred by selecting an action may not be inferred from observed feedback. A major part of this thesis focuses on the unsupervised sequential selection problem, where one can not infer the loss incurred for selecting an action from observed feedback. We also introduce a new setup named Censored Semi Bandits, where the loss incurred for selecting an action can be observed under certain conditions. Finally, we study the channel selection problem in the communication networks, where the reward for an action is only observed when no other player selects that action to play in the round. These problems find applications in many fields like healthcare, crowd-sourcing, security, adaptive resource allocation, among many others. This thesis aims to address the above-described sequential decision problems by exploiting specific structures these problems exhibit. We develop provably optimal algorithms for each of these setups with weak feedback and validate their empirical performance on different problem instances derived from synthetic and real datasets.  ( 2 min )

Text classification is a fundamental task in natural language processing (NLP). Several recent studies show the success of deep learning on text processing. Convolutional neural network (CNN), as a popular deep learning model, has shown remarkable success in the task of text classification. In this paper, new baseline models have been studied for text classification using CNN. In these models, documents are fed to the network as a three-dimensional tensor representation to provide sentence-level analysis. Applying such a method enables the models to take advantage of the positional information of the sentences in the text. Besides, analysing adjacent sentences allows extracting additional features. The proposed models have been compared with the state-of-the-art models using several datasets. The results have shown that the proposed models have better performance, particularly in the longer documents.

Message passing neural networks (MPNNs) learn the representation of graph-structured data based on graph original information, including node features and graph structures, and have shown astonishing improvement in node classification tasks. However, the expressive power of MPNNs is upper bounded by the first-order Weisfeiler-Leman test and its accuracy still has room for improvement. This work studies how to improve MPNNs' expressiveness and generalizability by fully exploiting graph original information both theoretically and empirically. It further proposes a new GNN model called INGNN (INformation-enhanced Graph Neural Network) that leverages the insights to improve node classification performance. Extensive experiments on both synthetic and real datasets demonstrate the superiority (average rank 1.78) of our INGNN compared with state-of-the-art methods.  ( 2 min )

Soft labels in image classification are vector representations of an image's true classification. In this paper, we investigate soft labels in the context of satellite object detection. We propose using detections as the basis for a new dataset of soft labels. Much of the effort in creating a high-quality model is gathering and annotating the training data. If we could use a model to generate a dataset for us, we could not only rapidly create datasets, but also supplement existing open-source datasets. Using a subset of the xView dataset, we train a YOLOv5 model to detect cars, planes, and ships. We then use that model to generate soft labels for the second training set which we then train and compare to the original model. We show that soft labels can be used to train a model that is almost as accurate as a model trained on the original data.  ( 2 min )

Transfer learning is an emerging and popular paradigm for utilizing existing knowledge from previous learning tasks to improve the performance of new ones. Despite its numerous empirical successes, theoretical analysis for transfer learning is limited. In this paper we build for the first time, to the best of our knowledge, a mathematical framework for the general procedure of transfer learning. Our unique reformulation of transfer learning as an optimization problem allows for the first time, analysis of its feasibility. Additionally, we propose a novel concept of transfer risk to evaluate transferability of transfer learning. Our numerical studies using the Office-31 dataset demonstrate the potential and benefits of incorporating transfer risk in the evaluation of transfer learning performance.

Counterexample-guided repair aims at creating neural networks with mathematical safety guarantees, facilitating the application of neural networks in safety-critical domains. However, whether counterexample-guided repair is guaranteed to terminate remains an open question. We approach this question by showing that counterexample-guided repair can be viewed as a robust optimisation algorithm. While termination guarantees for neural network repair itself remain beyond our reach, we prove termination for more restrained machine learning models and disprove termination in a general setting. We empirically study the practical implications of our theoretical results, demonstrating the suitability of common verifiers and falsifiers for repair despite a disadvantageous theoretical result. Additionally, we use our theoretical insights to devise a novel algorithm for repairing linear regression models, surpassing existing approaches.  ( 2 min )

Machine learning (ML) algorithms are showing a growing trend in helping the scientific communities across different disciplines and institutions to address large and diverse data problems. However, many available ML tools are programmatically demanding and computationally costly. The MLExchange project aims to build a collaborative platform equipped with enabling tools that allow scientists and facility users who do not have a profound ML background to use ML and computational resources in scientific discovery. At the high level, we are targeting a full user experience where managing and exchanging ML algorithms, workflows, and data are readily available through web applications. Since each component is an independent container, the whole platform or its individual service(s) can be easily deployed at servers of different scales, ranging from a personal device (laptop, smart phone, etc.) to high performance clusters (HPC) accessed (simultaneously) by many users. Thus, MLExchange renders flexible using scenarios -- users could either access the services and resources from a remote server or run the whole platform or its individual service(s) within their local network.  ( 2 min )

Actor-critic methods have achieved significant success in many challenging applications. However, its finite-time convergence is still poorly understood in its most practical form. Existing works on analyzing single-timescale actor-critic only focus on the i.i.d. sampling or tabular setting for simplicity. We consider the more practical online single-timescale actor-critic algorithm on continuous state space, where the critic is updated with a single Markovian sample per actor step. Existing analysis cannot conclude the convergence for such a challenging case. We prove that the online single-timescale actor-critic method is guaranteed to find an $\epsilon$-approximate stationary point with $\widetilde{\mathcal{O}}(\epsilon^{-2})$ sample complexity under standard assumptions, which can be further improved to $\mathcal{O}(\epsilon^{-2})$ under the i.i.d. sampling. We develop a novel framework that evaluates and controls the error propagation between actor and critic systematically. To our knowledge, this is the first finite-time analysis for the online single-timescale actor-critic method. Our results compare favorably to the existing literature in terms of considering the most practical yet challenging settings and requiring weaker assumptions.  ( 2 min )

Humans are well-versed in reasoning about the behaviors of physical objects and choosing actions accordingly to accomplish tasks, while it remains a major challenge for AI. To facilitate research addressing this problem, we propose a new testbed that requires an agent to reason about physical scenarios and take an action appropriately. Inspired by the physical knowledge acquired in infancy and the capabilities required for robots to operate in real-world environments, we identify 15 essential physical scenarios. We create a wide variety of distinct task templates, and we ensure all the task templates within the same scenario can be solved by using one specific strategic physical rule. By having such a design, we evaluate two distinct levels of generalization, namely the local generalization and the broad generalization. We conduct an extensive evaluation with human players, learning agents with varying input types and architectures, and heuristic agents with different strategies. Inspired by how human IQ is calculated, we define the physical reasoning quotient (Phy-Q score) that reflects the physical reasoning intelligence of an agent using the physical scenarios we considered. Our evaluation shows that 1) all agents are far below human performance, and 2) learning agents, even with good local generalization ability, struggle to learn the underlying physical reasoning rules and fail to generalize broadly. We encourage the development of intelligent agents that can reach the human level Phy-Q score. Website: https://github.com/phy-q/benchmark  ( 2 min )

Recently, flat-minima optimizers, which seek to find parameters in low-loss neighborhoods, have been shown to improve a neural network's generalization performance over stochastic and adaptive gradient-based optimizers. Two methods have received significant attention due to their scalability: 1. Stochastic Weight Averaging (SWA), and 2. Sharpness-Aware Minimization (SAM). However, there has been limited investigation into their properties and no systematic benchmarking of them across different domains. We fill this gap here by comparing the loss surfaces of the models trained with each method and through broad benchmarking across computer vision, natural language processing, and graph representation learning tasks. We discover several surprising findings from these results, which we hope will help researchers further improve deep learning optimizers, and practitioners identify the right optimizer for their problem.  ( 2 min )

We theoretically study the impact of differential privacy on fairness in classification. We prove that, given a class of models, popular group fairness measures are pointwise Lipschitz-continuous with respect to the parameters of the model. This result is a consequence of a more general statement on accuracy conditioned on an arbitrary event (such as membership to a sensitive group), which may be of independent interest. We use the aforementioned Lipschitz property to prove a high probability bound showing that, given enough examples, the fairness level of private models is close to the one of their non-private counterparts.  ( 2 min )

Sparse matrix representations are ubiquitous in computational science and machine learning, leading to significant reductions in compute time, in comparison to dense representation, for problems that have local connectivity. The adoption of sparse representation in leading ML frameworks such as PyTorch is incomplete, however, with support for both automatic differentiation and GPU acceleration missing. In this work, we present an implementation of a CSR-based sparse matrix wrapper for PyTorch with CUDA acceleration for basic matrix operations, as well as automatic differentiability. We also present several applications of the resulting sparse kernels to optimization problems, demonstrating ease of implementation and performance measurements versus their dense counterparts.  ( 2 min )

Sample-efficient offline reinforcement learning (RL) with linear function approximation has recently been studied extensively. Much of prior work has yielded the minimax-optimal bound of $\tilde{\mathcal{O}}(\frac{1}{\sqrt{K}})$, with $K$ being the number of episodes in the offline data. In this work, we seek to understand instance-dependent bounds for offline RL with function approximation. We present an algorithm called Bootstrapped and Constrained Pessimistic Value Iteration (BCP-VI), which leverages data bootstrapping and constrained optimization on top of pessimism. We show that under a partial data coverage assumption, that of \emph{concentrability} with respect to an optimal policy, the proposed algorithm yields a fast rate of $\tilde{\mathcal{O}}(\frac{1}{K})$ for offline RL when there is a positive gap in the optimal Q-value functions, even when the offline data were adaptively collected. Moreover, when the linear features of the optimal actions in the states reachable by an optimal policy span those reachable by the behavior policy and the optimal actions are unique, offline RL achieves absolute zero sub-optimality error when $K$ exceeds a (finite) instance-dependent threshold. To the best of our knowledge, these are the first $\tilde{\mathcal{O}}(\frac{1}{K})$ bound and absolute zero sub-optimality bound respectively for offline RL with linear function approximation from adaptive data with partial coverage. We also provide instance-agnostic and instance-dependent information-theoretical lower bounds to complement our upper bounds.  ( 2 min )

Calculation of Bayesian posteriors and model evidences typically requires numerical integration. Bayesian quadrature (BQ), a surrogate-model-based approach to numerical integration, is capable of superb sample efficiency, but its lack of parallelisation has hindered its practical applications. In this work, we propose a parallelised (batch) BQ method, employing techniques from kernel quadrature, that possesses an empirically exponential convergence rate. Additionally, just as with Nested Sampling, our method permits simultaneous inference of both posteriors and model evidence. Samples from our BQ surrogate model are re-selected to give a sparse set of samples, via a kernel recombination algorithm, requiring negligible additional time to increase the batch size. Empirically, we find that our approach significantly outperforms the sampling efficiency of both state-of-the-art BQ techniques and Nested Sampling in various real-world datasets, including lithium-ion battery analytics.  ( 2 min )

Modern approaches to supervised learning like deep neural networks (DNNs) typically implicitly assume that observed responses are statistically independent. In contrast, correlated data are prevalent in real-life large-scale applications, with typical sources of correlation including spatial, temporal and clustering structures. These correlations are either ignored by DNNs, or ad-hoc solutions are developed for specific use cases. We propose to use the mixed models framework to handle correlated data in DNNs. By treating the effects underlying the correlation structure as random effects, mixed models are able to avoid overfitted parameter estimates and ultimately yield better predictive performance. The key to combining mixed models and DNNs is using the Gaussian negative log-likelihood (NLL) as a natural loss function that is minimized with DNN machinery including stochastic gradient descent (SGD). Since NLL does not decompose like standard DNN loss functions, the use of SGD with NLL presents some theoretical and implementation challenges, which we address. Our approach which we call LMMNN is demonstrated to improve performance over natural competitors in various correlation scenarios on diverse simulated and real datasets. Our focus is on a regression setting and tabular datasets, but we also show some results for classification. Our code is available at https://github.com/gsimchoni/lmmnn.  ( 2 min )

Real-world data for classification is often labeled by multiple annotators. For analyzing such data, we introduce CROWDLAB, a straightforward approach to utilize any trained classifier to estimate: (1) A consensus label for each example that aggregates the available annotations; (2) A confidence score for how likely each consensus label is correct; (3) A rating for each annotator quantifying the overall correctness of their labels. Existing algorithms to estimate related quantities in crowdsourcing often rely on sophisticated generative models with iterative inference. CROWDLAB instead uses a straightforward weighted ensemble. Existing algorithms often rely solely on annotator statistics, ignoring the features of the examples from which the annotations derive. CROWDLAB utilizes any classifier model trained on these features, and can thus better generalize between examples with similar features. On real-world multi-annotator image data, our proposed method provides superior estimates for (1)-(3) than existing algorithms like Dawid-Skene/GLAD.  ( 2 min )

Creating fast and accurate force fields is a long-standing challenge in computational chemistry and materials science. Recently, several equivariant message passing neural networks (MPNNs) have been shown to outperform models built using other approaches in terms of accuracy. However, most MPNNs suffer from high computational cost and poor scalability. We propose that these limitations arise because MPNNs only pass two-body messages leading to a direct relationship between the number of layers and the expressivity of the network. In this work, we introduce MACE, a new equivariant MPNN model that uses higher body order messages. In particular, we show that using four-body messages reduces the required number of message passing iterations to just two, resulting in a fast and highly parallelizable model, reaching or exceeding state-of-the-art accuracy on the rMD17, 3BPA, and AcAc benchmark tasks. We also demonstrate that using higher order messages leads to an improved steepness of the learning curves.  ( 2 min )

Recent progress in empirical and certified robustness promises to deliver reliable and deployable Deep Neural Networks (DNNs). Despite that success, most existing evaluations of DNN robustness have been done on images sampled from the same distribution on which the model was trained. However, in the real world, DNNs may be deployed in dynamic environments that exhibit significant distribution shifts. In this work, we take a first step towards thoroughly investigating the interplay between empirical and certified adversarial robustness on one hand and domain generalization on another. To do so, we train robust models on multiple domains and evaluate their accuracy and robustness on an unseen domain. We observe that: (1) both empirical and certified robustness generalize to unseen domains, and (2) the level of generalizability does not correlate well with input visual similarity, measured by the FID between source and target domains. We also extend our study to cover a real-world medical application, in which adversarial augmentation significantly boosts the generalization of robustness with minimal effect on clean data accuracy.  ( 2 min )

In e-commerce, the salience of commonsense knowledge (CSK) is beneficial for widespread applications such as product search and recommendation. For example, when users search for ``running'' in e-commerce, they would like to find products highly related to running, such as ``running shoes'' rather than ``shoes''. Nevertheless, many existing CSK collections rank statements solely by confidence scores, and there is no information about which ones are salient from a human perspective. In this work, we define the task of supervised salience evaluation, where given a CSK triple, the model is required to learn whether the triple is salient or not. In addition to formulating the new task, we also release a new Benchmark dataset of Salience Evaluation in E-commerce (BSEE) and hope to promote related research on commonsense knowledge salience evaluation. We conduct experiments in the dataset with several representative baseline models. The experimental results show that salience evaluation is a challenging task where models perform poorly on our evaluation set. We further propose a simple but effective approach, PMI-tuning, which shows promise for solving this novel problem. Code is available in \url{https://github.com/OpenBGBenchmark/OpenBG-CSK.  ( 2 min )

It has been increasingly demanding to develop reliable Graph Neural Network (GNN) evaluation methods to quantify the progress of the rapidly expanding GNN research. Existing GNN benchmarking methods focus on comparing the GNNs with respect to their performances on some node/graph classification/regression tasks in certain datasets. There lacks a principled, task-agnostic method to directly compare two GNNs. Moreover, most of the existing graph self-supervised learning (SSL) works incorporate handcrafted augmentations to the graph, which has several severe difficulties due to the unique characteristics of graph-structured data. To address the aforementioned issues, we propose GraphAC (Graph Adversarial Collaboration) -- a conceptually novel, principled, task-agnostic, and stable framework for evaluating GNNs through contrastive self-supervision. GraphAC succeeds in distinguishing GNNs of different expressiveness across various aspects, and has been proven to be a principled and reliable GNN evaluation method, eliminating the need for handcrafted augmentations for stable SSL.  ( 2 min )

This paper analyzes the convergence and generalization of training a one-hidden-layer neural network when the input features follow the Gaussian mixture model consisting of a finite number of Gaussian distributions. Assuming the labels are generated from a teacher model with an unknown ground truth weight, the learning problem is to estimate the underlying teacher model by minimizing a non-convex risk function over a student neural network. With a finite number of training samples, referred to the sample complexity, the iterations are proved to converge linearly to a critical point with guaranteed generalization error. In addition, for the first time, this paper characterizes the impact of the input distributions on the sample complexity and the learning rate.  ( 2 min )

We propose a novel high-performance, parameter and computationally efficient deep learning architecture for tabular data, Gated Additive Tree Ensemble(GATE). GATE uses a gating mechanism, inspired from GRU, as a feature representation learning unit with an in-built feature selection mechanism. We combine it with an ensemble of differentiable, non-linear decision trees, re-weighted with simple self-attention to predict our desired output. We demonstrate that GATE is a competitive alternative to SOTA approaches like GBDTs, NODE, FT Transformers, etc. by experiments on several public datasets (both classification and regression). We have made available the code at https://github.com/manujosephv/GATE under MIT License.  ( 2 min )

Large language models (LLMs) have displayed an impressive ability to harness natural language to perform complex tasks. In this work, we explore whether we can leverage this learned ability to find and explain patterns in data. Specifically, given a pre-trained LLM and data examples, we introduce interpretable autoprompting (iPrompt), an algorithm that generates a natural-language string explaining the data. iPrompt iteratively alternates between generating explanations with an LLM and reranking them based on their performance when used as a prompt. Experiments on a wide range of datasets, from synthetic mathematics to natural-language understanding, show that iPrompt can yield meaningful insights by accurately finding groundtruth dataset descriptions. Moreover, the prompts produced by iPrompt are simultaneously human-interpretable and highly effective for generalization: on real-world sentiment classification datasets, iPrompt produces prompts that match or even improve upon human-written prompts for GPT-3. Finally, experiments with an fMRI dataset show the potential for iPrompt to aid in scientific discovery. All code for using the methods and data here is made available on Github.  ( 2 min )

We consider a multi-agent multi-armed bandit setting in which $n$ honest agents collaborate over a network to minimize regret but $m$ malicious agents can disrupt learning arbitrarily. Assuming the network is the complete graph, existing algorithms incur $O( (m + K/n) \log (T) / \Delta )$ regret in this setting, where $K$ is the number of arms and $\Delta$ is the arm gap. For $m \ll K$, this improves over the single-agent baseline regret of $O(K\log(T)/\Delta)$. In this work, we show the situation is murkier beyond the case of a complete graph. In particular, we prove that if the state-of-the-art algorithm is used on the undirected line graph, honest agents can suffer (nearly) linear regret until time is doubly exponential in $K$ and $n$. In light of this negative result, we propose a new algorithm for which the $i$-th agent has regret $O( ( d_{\text{mal}}(i) + K/n) \log(T)/\Delta)$ on any connected and undirected graph, where $d_{\text{mal}}(i)$ is the number of $i$'s neighbors who are malicious. Thus, we generalize existing regret bounds beyond the complete graph (where $d_{\text{mal}}(i) = m$), and show the effect of malicious agents is entirely local (in the sense that only the $d_{\text{mal}}(i)$ malicious agents directly connected to $i$ affect its long-term regret).  ( 2 min )

We study statistical inference on the similarity/distance between two time-series under uncertain environment by considering a statistical hypothesis test on the distance obtained from Dynamic Time Warping (DTW) algorithm. The sampling distribution of the DTW distance is too difficult to derive because it is obtained based on the solution of the DTW algorithm, which is complicated. To circumvent this difficulty, we propose to employ the conditional selective inference framework, which enables us to derive a valid inference method on the DTW distance. To our knowledge, this is the first method that can provide a valid p-value to quantify the statistical significance of the DTW distance, which is helpful for high-stake decision making such as abnormal time-series detection problems. We evaluate the performance of the proposed inference method on both synthetic and real-world datasets.  ( 2 min )

Learning in neural networks is often framed as a problem in which targeted error signals are directly propagated to parameters and used to produce updates that induce more optimal network behaviour. Backpropagation of error (BP) is an example of such an approach and has proven to be a highly successful application of stochastic gradient descent to deep neural networks. We propose constrained parameter inference (COPI) as a new principle for learning. The COPI approach assumes that learning can be set up in a manner where parameters infer their own values based upon observations of their local neuron activities. We find that this estimation of network parameters is possible under the constraints of decorrelated neural inputs and top-down perturbations of neural states for credit assignment. We show that the decorrelation required for COPI allows learning at extremely high learning rates, competitive with that of adaptive optimizers, as used by BP. We further demonstrate that COPI affords a new approach to feature analysis and network compression. Finally, we argue that COPI may shed new light on learning in biological networks given the evidence for decorrelation in the brain.

Recent research has turned to Reinforcement Learning (RL) to solve challenging decision problems, as an alternative to hand-tuned heuristics. RL can learn good policies without the need for modeling the environment's dynamics. Despite this promise, RL remains an impractical solution for many real-world systems problems. A particularly challenging case occurs when the environment changes over time, i.e. it exhibits non-stationarity. In this work, we characterize the challenges introduced by non-stationarity, shed light on the range of approaches to them and develop a robust framework for addressing them to train RL agents in live systems. Such agents must explore and learn new environments, without hurting the system's performance, and remember them over time. To this end, our framework (i) identifies different environments encountered by the live system, (ii) triggers exploration when necessary, (iii) takes precautions to retain knowledge from prior environments, and (iv) employs safeguards to protect the system's performance when the RL agent makes mistakes. We apply our framework to two systems problems, straggler mitigation and adaptive video streaming, and evaluate it against a variety of alternative approaches using real-world and synthetic data. We show that all components of the framework are necessary to cope with non-stationarity and provide guidance on alternative design choices for each component.

AdaBoost is a classic boosting algorithm for combining multiple inaccurate classifiers produced by a weak learner, to produce a strong learner with arbitrarily high accuracy when given enough training data. Determining the optimal number of samples necessary to obtain a given accuracy of the strong learner, is a basic learning theoretic question. Larsen and Ritzert (NeurIPS'22) recently presented the first provably optimal weak-to-strong learner. However, their algorithm is somewhat complicated and it remains an intriguing question whether the prototypical boosting algorithm AdaBoost also makes optimal use of training samples. In this work, we answer this question in the negative. Concretely, we show that the sample complexity of AdaBoost, and other classic variations thereof, are sub-optimal by at least one logarithmic factor in the desired accuracy of the strong learner.  ( 2 min )

Neural network models become increasingly popular as dynamic modeling tools in the control community. They have many appealing features including nonlinear structures, being able to approximate any functions. While most researchers hold optimistic attitudes towards such models, this paper questions the capability of (deep) neural networks for the modeling of dynamic systems using input-output data. For the identification of linear time-invariant (LTI) dynamic systems, two representative neural network models, Long Short-Term Memory (LSTM) and Cascade Foward Neural Network (CFNN) are compared to the standard Prediction Error Method (PEM) of system identification. In the comparison, four essential aspects of system identification are considered, then several possible defects and neglected issues of neural network based modeling are pointed out. Detailed simulation studies are performed to verify these defects: for the LTI system, both LSTM and CFNN fail to deliver consistent models even in noise-free cases; and they give worse results than PEM in noisy cases.  ( 2 min )

Existing Deep Reinforcement Learning (DRL) algorithms suffer from sample inefficiency. Generally, episodic control-based approaches are solutions that leverage highly-rewarded past experiences to improve sample efficiency of DRL algorithms. However, previous episodic control-based approaches fail to utilize the latent information from the historical behaviors (e.g., state transitions, topological similarities, etc.) and lack scalability during DRL training. This work introduces Neural Episodic Control with State Abstraction (NECSA), a simple but effective state abstraction-based episodic control containing a more comprehensive episodic memory, a novel state evaluation, and a multi-step state analysis. We evaluate our approach to the MuJoCo and Atari tasks in OpenAI gym domains. The experimental results indicate that NECSA achieves higher sample efficiency than the state-of-the-art episodic control-based approaches. Our data and code are available at the project website\footnote{\url{https://sites.google.com/view/drl-necsa}}.  ( 2 min )

Recent years witnessed a remarkable increase in the availability of data and computing resources in communication networks. This contributed to the rise of data-driven over model-driven algorithms for network automation. This paper investigates a Minimization of Drive Tests (MDT)-driven Deep Reinforcement Learning (DRL) algorithm to optimize coverage and capacity by tuning antennas tilts on a cluster of cells from TIM's cellular network. We jointly utilize MDT data, electromagnetic simulations, and network Key Performance indicators (KPIs) to define a simulated network environment for the training of a Deep Q-Network (DQN) agent. Some tweaks have been introduced to the classical DQN formulation to improve the agent's sample efficiency, stability, and performance. In particular, a custom exploration policy is designed to introduce soft constraints at training time. Results show that the proposed algorithm outperforms baseline approaches like DQN and best-fist search in terms of long-term reward and sample efficiency. Our results indicate that MDT-driven approaches constitute a valuable tool for autonomous coverage and capacity optimization of mobile radio networks.

In this work, we present an analysis of the generalization of Neural Operators (NOs) and derived architectures. We proposed a family of networks, which we name (${\textit{s}}{\text{NO}}+\varepsilon$), where we modify the layout of NOs towards an architecture resembling a Transformer; mainly, we substitute the Attention module with the Integral Operator part of NOs. The resulting network preserves universality, has a better generalization to unseen data, and similar number of parameters as NOs. On the one hand, we study numerically the generalization by gradually transforming NOs into ${\textit{s}}{\text{NO}}+\varepsilon$ and verifying a reduction of the test loss considering a time-harmonic wave dataset with different frequencies. We perform the following changes in NOs: (a) we split the Integral Operator (non-local) and the (local) feed-forward network (MLP) into different layers, generating a {\it sequential} structure which we call sequential Neural Operator (${\textit{s}}{\text{NO}}$), (b) we add the skip connection, and layer normalization in ${\textit{s}}{\text{NO}}$, and (c) we incorporate dropout and stochastic depth that allows us to generate deep networks. In each case, we observe a decrease in the test loss in a wide variety of initialization, indicating that our changes outperform the NO. On the other hand, building on infinite-dimensional Statistics, and in particular the Dudley Theorem, we provide bounds of the Rademacher complexity of NOs and ${\textit{s}}{\text{NO}}$, and we find the following relationship: the upper bound of the Rademacher complexity of the ${\textit{s}}{\text{NO}}$ is a lower-bound of the NOs, thereby, the generalization error bound of ${\textit{s}}{\text{NO}}$ is smaller than NO, which further strengthens our numerical results.

Among the reasons hindering reinforcement learning (RL) applications to real-world problems, two factors are critical: limited data and the mismatch between the testing environment (real environment in which the policy is deployed) and the training environment (e.g., a simulator). This paper attempts to address these issues simultaneously with distributionally robust offline RL, where we learn a distributionally robust policy using historical data obtained from the source environment by optimizing against a worst-case perturbation thereof. In particular, we move beyond tabular settings and consider linear function approximation. More specifically, we consider two settings, one where the dataset is well-explored and the other where the dataset has sufficient coverage of the optimal policy. We propose two algorithms~-- one for each of the two settings~-- that achieve error bounds $\tilde{O}(d^{1/2}/N^{1/2})$ and $\tilde{O}(d^{3/2}/N^{1/2})$ respectively, where $d$ is the dimension in the linear function approximation and $N$ is the number of trajectories in the dataset. To the best of our knowledge, they provide the first non-asymptotic results of the sample complexity in this setting. Diverse experiments are conducted to demonstrate our theoretical findings, showing the superiority of our algorithm against the non-robust one.

Heavy-tail phenomena in stochastic gradient descent (SGD) have been reported in several empirical studies. Experimental evidence in previous works suggests a strong interplay between the heaviness of the tails and generalization behavior of SGD. To address this empirical phenomena theoretically, several works have made strong topological and statistical assumptions to link the generalization error to heavy tails. Very recently, new generalization bounds have been proven, indicating a non-monotonic relationship between the generalization error and heavy tails, which is more pertinent to the reported empirical observations. While these bounds do not require additional topological assumptions given that SGD can be modeled using a heavy-tailed stochastic differential equation (SDE), they can only apply to simple quadratic problems. In this paper, we build on this line of research and develop generalization bounds for a more general class of objective functions, which includes non-convex functions as well. Our approach is based on developing Wasserstein stability bounds for heavy-tailed SDEs and their discretizations, which we then convert to generalization bounds. Our results do not require any nontrivial assumptions; yet, they shed more light to the empirical observations, thanks to the generality of the loss functions.

This paper presents ExplainableFold, an explainable AI framework for protein structure prediction. Despite the success of AI-based methods such as AlphaFold in this field, the underlying reasons for their predictions remain unclear due to the black-box nature of deep learning models. To address this, we propose a counterfactual learning framework inspired by biological principles to generate counterfactual explanations for protein structure prediction, enabling a dry-lab experimentation approach. Our experimental results demonstrate the ability of ExplainableFold to generate high-quality explanations for AlphaFold's predictions, providing near-experimental understanding of the effects of amino acids on 3D protein structure. This framework has the potential to facilitate a deeper understanding of protein structures.

In medical genetics, each genetic variant is evaluated as an independent entity regarding its clinical importance. However, in most complex diseases, variant combinations in specific gene networks, rather than the presence of a particular single variant, predominates. In the case of complex diseases, disease status can be evaluated by considering the success level of a team of specific variants. We propose a high dimensional modelling based method to analyse all the variants in a gene network together. To evaluate our method, we selected two gene networks, mTOR and TGF-Beta. For each pathway, we generated 400 control and 400 patient group samples. mTOR and TGF-? pathways contain 31 and 93 genes of varying sizes, respectively. We produced Chaos Game Representation images for each gene sequence to obtain 2-D binary patterns. These patterns were arranged in succession, and a 3-D tensor structure was achieved for each gene network. Features for each data sample were acquired by exploiting Enhanced Multivariance Products Representation to 3-D data. Features were split as training and testing vectors. Training vectors were employed to train a Support Vector Machines classification model. We achieved more than 96% and 99% classification accuracies for mTOR and TGF-Beta networks, respectively, using a limited amount of training samples.

Modern deep learning techniques have illustrated their excellent capabilities in many areas, but relies on large training data. Optimization-based meta-learning train a model on a variety tasks, such that it can solve new learning tasks using only a small number of training samples.However, these methods assumes that training and test dataare identically and independently distributed. To overcome such limitation, in this paper, we propose invariant meta learning for out-of-distribution tasks. Specifically, invariant meta learning find invariant optimal meta-initialization,and fast adapt to out-of-distribution tasks with regularization penalty. Extensive experiments demonstrate the effectiveness of our proposed invariant meta learning on out-of-distribution few-shot tasks.

The intersection of social media, low-cost trading platforms, and naive investors has created an ideal situation for information-based market manipulations, especially pump&dumps. Manipulators accumulate small-cap stocks, disseminate false information on social media to inflate their price, and sell at the peak. We collect a dataset of stocks whose price and volume profiles have the characteristic shape of a pump&dump, and social media posts for those same stocks that match the timing of the initial price rises. From these we build predictive models for pump&dump events based on the language used in the social media posts. There are multiple difficulties: not every post will cause the intended market reaction, some pump&dump events may be triggered by posts in other forums, and there may be accidental confluences of post timing and market movements. Nevertheless, our best model achieves a prediction accuracy of 85% and an F1-score of 62%. Such a tool can provide early warning to investors and regulators that a pump&dump may be underway.

PCANet and its variants provided good accuracy results for classification tasks. However, despite the importance of network depth in achieving good classification accuracy, these networks were trained with a maximum of nine layers. In this paper, we introduce a residual compensation convolutional network, which is the first PCANet-like network trained with hundreds of layers while improving classification accuracy. The design of the proposed network consists of several convolutional layers, each followed by post-processing steps and a classifier. To correct the classification errors and significantly increase the network's depth, we train each layer with new labels derived from the residual information of all its preceding layers. This learning mechanism is accomplished by traversing the network's layers in a single forward pass without backpropagation or gradient computations. Our experiments on four distinct classification benchmarks (MNIST, CIFAR-10, CIFAR-100, and TinyImageNet) show that our deep network outperforms all existing PCANet-like networks and is competitive with several traditional gradient-based models.  ( 2 min )

Convolutional neural networks (CNN) have been successful in machine learning applications. Their success relies on their ability to consider space invariant local features. We consider the use of CNN to fit nuisance models in semiparametric estimation of the average causal effect of a treatment. In this setting, nuisance models are functions of pre-treatment covariates that need to be controlled for. In an application where we want to estimate the effect of early retirement on a health outcome, we propose to use CNN to control for time-structured covariates. Thus, CNN is used when fitting nuisance models explaining the treatment and the outcome. These fits are then combined into an augmented inverse probability weighting estimator yielding efficient and uniformly valid inference. Theoretically, we contribute by providing rates of convergence for CNN equipped with the rectified linear unit activation function and compare it to an existing result for feedforward neural networks. We also show when those rates guarantee uniformly valid inference. A Monte Carlo study is provided where the performance of the proposed estimator is evaluated and compared with other strategies. Finally, we give results on a study of the effect of early retirement on hospitalization using data covering the whole Swedish population.  ( 2 min )

Since the recent advent of regulations for data protection (e.g., the General Data Protection Regulation), there has been increasing demand in deleting information learned from sensitive data in pre-trained models without retraining from scratch. The inherent vulnerability of neural networks towards adversarial attacks and unfairness also calls for a robust method to remove or correct information in an instance-wise fashion, while retaining the predictive performance across remaining data. To this end, we define instance-wise unlearning, of which the goal is to delete information on a set of instances from a pre-trained model, by either misclassifying each instance away from its original prediction or relabeling the instance to a different label. We also propose two methods that reduce forgetting on the remaining data: 1) utilizing adversarial examples to overcome forgetting at the representation-level and 2) leveraging weight importance metrics to pinpoint network parameters guilty of propagating unwanted information. Both methods only require the pre-trained model and data instances to forget, allowing painless application to real-life settings where the entire training set is unavailable. Through extensive experimentation on various image classification benchmarks, we show that our approach effectively preserves knowledge of remaining data while unlearning given instances in both single-task and continual unlearning scenarios.  ( 2 min )

Critical servers can be secured against distributed denial of service (DDoS) attacks using proof of work (PoW) systems assisted by an Artificial Intelligence (AI) that learns contextual network request patterns. In this work, we introduce CAPoW, a context-aware anti-DDoS framework that injects latency adaptively during communication by utilizing context-aware PoW puzzles. In CAPoW, a security professional can define relevant request context attributes which can be learned by the AI system. These contextual attributes can include information about the user request, such as IP address, time, flow-level information, etc., and are utilized to generate a contextual score for incoming requests that influence the hardness of a PoW puzzle. These puzzles need to be solved by a user before the server begins to process their request. Solving puzzles slow down the volume of incoming adversarial requests. Additionally, the framework compels the adversary to incur a cost per request, hence making it expensive for an adversary to prolong a DDoS attack. We include the theoretical foundations of the CAPoW framework along with a description of its implementation and evaluation.

We propose a novel denoising diffusion generative model for predicting nonlinear fluid fields named FluidDiff. By performing a diffusion process, the model is able to learn a complex representation of the high-dimensional dynamic system, and then Langevin sampling is used to generate predictions for the flow state under specified initial conditions. The model is trained with finite, discrete fluid simulation data. We demonstrate that our model has the capacity to model the distribution of simulated training data and that it gives accurate predictions on the test data. Without encoded prior knowledge of the underlying physical system, it shares competitive performance with other deep learning models for fluid prediction, which is promising for investigation on new computational fluid dynamics methods.  ( 2 min )

Transfer learning for partial differential equations (PDEs) is to develop a pre-trained neural network that can be used to solve a wide class of PDEs. Existing transfer learning approaches require much information of the target PDEs such as its formulation and/or data of its solution for pre-training. In this work, we propose to construct transferable neural feature spaces from purely function approximation perspectives without using PDE information. The construction of the feature space involves re-parameterization of the hidden neurons and uses auxiliary functions to tune the resulting feature space. Theoretical analysis shows the high quality of the produced feature space, i.e., uniformly distributed neurons. Extensive numerical experiments verify the outstanding performance of our method, including significantly improved transferability, e.g., using the same feature space for various PDEs with different domains and boundary conditions, and the superior accuracy, e.g., several orders of magnitude smaller mean squared error than the state of the art methods.  ( 2 min )

Hyperspectral image denoising is unique for the highly similar and correlated spectral information that should be properly considered. However, existing methods show limitations in exploring the spectral correlations across different bands and feature interactions within each band. Besides, the low- and high-level features usually exhibit different importance for different spatial-spectral regions, which is not fully explored for current algorithms as well. In this paper, we present a Mixed Attention Network (MAN) that simultaneously considers the inter- and intra-spectral correlations as well as the interactions between low- and high-level spatial-spectral meaningful features. Specifically, we introduce a multi-head recurrent spectral attention that efficiently integrates the inter-spectral features across all the spectral bands. These features are further enhanced with a progressive spectral channel attention by exploring the intra-spectral relationships. Moreover, we propose an attentive skip-connection that adaptively controls the proportion of the low- and high-level spatial-spectral features from the encoder and decoder to better enhance the aggregated features. Extensive experiments show that our MAN outperforms existing state-of-the-art methods on simulated and real noise settings while maintaining a low cost of parameters and running time.

Federated Learning is a distributed machine learning environment, which ensures that clients complete collaborative training without sharing private data, only by exchanging parameters. However, the data does not satisfy the same distribution and the computing resources of clients are different, which brings challenges to the related research. To better solve the above heterogeneous problems, we designed a novel federated learning method. The local model consists of the pre-trained model as the backbone and fully connected layers as the head. The backbone can extract features for the head, and the embedding vector of classes is shared between clients to optimize the head so that the local model can perform better. By sharing the embedding vector of classes, instead of parameters based on gradient space, clients can better adapt to private data, and it is more efficient in the communication between the server and clients. To better protect privacy, we proposed a privacy-preserving hybrid method to add noise to the embedding vector of classes, which has less impact on the local model performance under the premise of satisfying differential privacy. We conduct a comprehensive evaluation with other federated learning methods on the self-built vehicle dataset under non-independent identically distributed(Non-IID)  ( 2 min )

In fair classification, it is common to train a model, and to compare and correct subgroup-specific error rates for disparities. However, even if a model's classification decisions satisfy a fairness metric, it is not necessarily the case that these decisions are equally confident. This becomes clear if we measure variance: We can fix everything in the learning process except the subset of training data, train multiple models, measure (dis)agreement in predictions for each test example, and interpret disagreement to mean that the learning process is more unstable with respect to its classification decision. Empirically, some decisions can in fact be so unstable that they are effectively arbitrary. To reduce this arbitrariness, we formalize a notion of self-consistency of a learning process, develop an ensembling algorithm that provably increases self-consistency, and empirically demonstrate its utility to often improve both fairness and accuracy. Further, our evaluation reveals a startling observation: Applying ensembling to common fair classification benchmarks can significantly reduce subgroup error rate disparities, without employing common pre-, in-, or post-processing fairness interventions. Taken together, our results indicate that variance, particularly on small datasets, can muddle the reliability of conclusions about fairness. One solution is to develop larger benchmark tasks. To this end, we release a toolkit that makes the Home Mortgage Disclosure Act datasets easily usable for future research.  ( 2 min )

Despite the great development of document summarization techniques nowadays, factual inconsistencies between the generated summaries and the original text still occur from time to time. This paper proposes a prefix-tuning-based approach that uses a set of trainable continuous prefix prompt together with discrete prompts to aid model generation, which makes a significant impact on both CNN/Daily Mail and XSum summaries generated using GPT-2. The improvements on fact preservation in the generated summaries indicates the effectiveness of adopting this prefix-tuning-based method in knowledge-enhanced document summarization, and also shows a great potential on other natural language processing tasks.  ( 2 min )

This paper studies the problem of learning a control policy without the need for interactions with the environment; instead, learning purely from an existing dataset. Prior work has demonstrated that offline learning algorithms (e.g., behavioural cloning and offline reinforcement learning) are more likely to discover a satisfactory policy when trained using high-quality expert data. However, many real-world/practical datasets can contain significant proportions of examples generated using low-skilled agents. Therefore, we propose a behaviour discriminator (BD) concept, a novel and simple data filtering approach based on semi-supervised learning, which can accurately discern expert data from a mixed-quality dataset. Our BD approach was used to pre-process the mixed-skill-level datasets from the Real Robot Challenge (RRC) III, an open competition requiring participants to solve several dexterous robotic manipulation tasks using offline learning methods; the new BD method allowed a standard behavioural cloning algorithm to outperform other more sophisticated offline learning algorithms. Moreover, we demonstrate that the new BD pre-processing method can be applied to a number of D4RL benchmark problems, improving the performance of multiple state-of-the-art offline reinforcement learning algorithms.  ( 2 min )

Large-scale data missing is a challenging problem in Intelligent Transportation Systems (ITS). Many studies have been carried out to impute large-scale traffic data by considering their spatiotemporal correlations at a network level. In existing traffic data imputations, however, rich semantic information of a road network has been largely ignored when capturing network-wide spatiotemporal correlations. This study proposes a Graph Transformer for Traffic Data Imputation (GT-TDI) model to impute large-scale traffic data with spatiotemporal semantic understanding of a road network. Specifically, the proposed model introduces semantic descriptions consisting of network-wide spatial and temporal information of traffic data to help the GT-TDI model capture spatiotemporal correlations at a network level. The proposed model takes incomplete data, the social connectivity of sensors, and semantic descriptions as input to perform imputation tasks with the help of Graph Neural Networks (GNN) and Transformer. On the PeMS freeway dataset, extensive experiments are conducted to compare the proposed GT-TDI model with conventional methods, tensor factorization methods, and deep learning-based methods. The results show that the proposed GT-TDI outperforms existing methods in complex missing patterns and diverse missing rates. The code of the GT-TDI model will be available at https://github.com/KP-Zhang/GT-TDI.  ( 2 min )

As research and practice in artificial intelligence (A.I.) grow in leaps and bounds, the resources necessary to sustain and support their operations also grow at an increasing pace. While innovations and applications from A.I. have brought significant advances, from applications to vision and natural language to improvements to fields like medical imaging and materials engineering, their costs should not be neglected. As we embrace a world with ever-increasing amounts of data as well as research and development of A.I. applications, we are sure to face an ever-mounting energy footprint to sustain these computational budgets, data storage needs, and more. But, is this sustainable and, more importantly, what kind of setting is best positioned to nurture such sustainable A.I. in both research and practice? In this paper, we outline our outlook for Green A.I. -- a more sustainable, energy-efficient and energy-aware ecosystem for developing A.I. across the research, computing, and practitioner communities alike -- and the steps required to arrive there. We present a bird's eye view of various areas for potential changes and improvements from the ground floor of AI's operational and hardware optimizations for datacenters/HPCs to the current incentive structures in the world of A.I. research and practice, and more. We hope these points will spur further discussion, and action, on some of these issues and their potential solutions.  ( 2 min )

Constrained Reinforcement Learning has been employed to enforce safety constraints on policy through the use of expected cost constraints. The key challenge is in handling expected cost accumulated using the policy and not just in a single step. Existing methods have developed innovative ways of converting this cost constraint over entire policy to constraints over local decisions (at each time step). While such approaches have provided good solutions with regards to objective, they can either be overly aggressive or conservative with respect to costs. This is owing to use of estimates for "future" or "backward" costs in local cost constraints. To that end, we provide an equivalent unconstrained formulation to constrained RL that has an augmented state space and reward penalties. This intuitive formulation is general and has interesting theoretical properties. More importantly, this provides a new paradigm for solving constrained RL problems effectively. As we show in our experimental results, we are able to outperform leading approaches on multiple benchmark problems from literature.

Several machine learning (ML) applications are characterized by searching for an optimal solution to a complex task. The search space for this optimal solution is often very large, so large in fact that this optimal solution is often not computable. Part of the problem is that many candidate solutions found via ML are actually infeasible and have to be discarded. Restricting the search space to only the feasible solution candidates simplifies finding an optimal solution for the tasks. Further, the set of feasible solutions could be re-used in multiple problems characterized by different tasks. In particular, we observe that complex tasks can be decomposed into subtasks and corresponding skills. We propose to learn a reusable and transferable skill by training an actor to generate all feasible actions. The trained actor can then propose feasible actions, among which an optimal one can be chosen according to a specific task. The actor is trained by interpreting the feasibility of each action as a target distribution. The training procedure minimizes a divergence of the actor's output distribution to this target. We derive the general optimization target for arbitrary f-divergences using a combination of kernel density estimates, resampling, and importance sampling. We further utilize an auxiliary critic to reduce the interactions with the environment. A preliminary comparison to related strategies shows that our approach learns to visit all the modes in the feasible action space, demonstrating the framework's potential for learning skills that can be used in various downstream tasks.

Social media is a modern person's digital voice to project and engage with new ideas and mobilise communities $\unicode{x2013}$ a power shared with extremists. Given the societal risks of unvetted content-moderating algorithms for Extremism, Radicalisation, and Hate speech (ERH) detection, responsible software engineering must understand the who, what, when, where, and why such models are necessary to protect user safety and free expression. Hence, we propose and examine the unique research field of ERH context mining to unify disjoint studies. Specifically, we evaluate the start-to-finish design process from socio-technical definition-building and dataset collection strategies to technical algorithm design and performance. Our 2015-2021 51-study Systematic Literature Review (SLR) provides the first cross-examination of textual, network, and visual approaches to detecting extremist affiliation, hateful content, and radicalisation towards groups and movements. We identify consensus-driven ERH definitions and propose solutions to existing ideological and geographic biases, particularly due to the lack of research in Oceania/Australasia. Our hybridised investigation on Natural Language Processing, Community Detection, and visual-text models demonstrates the dominating performance of textual transformer-based algorithms. We conclude with vital recommendations for ERH context mining researchers and propose an uptake roadmap with guidelines for researchers, industries, and governments to enable a safer cyberspace.  ( 2 min )

Semantic communication is a novel communication paradigm that focuses on recognizing and delivering the desired meaning of messages to the destination users. Most existing works in this area focus on delivering explicit semantics, labels or signal features that can be directly identified from the source signals. In this paper, we consider the implicit semantic communication problem in which hidden relations and closely related semantic terms that cannot be recognized from the source signals need to also be delivered to the destination user. We develop a novel adversarial learning-based implicit semantic-aware communication (iSAC) architecture in which the source user, instead of maximizing the total amount of information transmitted to the channel, aims to help the recipient learn an inference rule that can automatically generate implicit semantics based on limited clue information. We prove that by applying iSAC, the destination user can always learn an inference rule that matches the true inference rule of the source messages. Experimental results show that the proposed iSAC can offer up to a 19.69 dB improvement over existing non-inferential communication solutions, in terms of symbol error rate at the destination user.  ( 2 min )

In this article, we use probing to investigate phenomena that occur during fine-tuning and knowledge distillation of a BERT-based natural language understanding (NLU) model. Our ultimate purpose was to use probing to better understand practical production problems and consequently to build better NLU models. We designed experiments to see how fine-tuning changes the linguistic capabilities of BERT, what the optimal size of the fine-tuning dataset is, and what amount of information is contained in a distilled NLU based on a tiny Transformer. The results of the experiments show that the probing paradigm in its current form is not well suited to answer such questions. Structural, Edge and Conditional probes do not take into account how easy it is to decode probed information. Consequently, we conclude that quantification of information decodability is critical for many practical applications of the probing paradigm.  ( 2 min )

We study the problem of online learning in a two-player decentralized cooperative Stackelberg game. In each round, the leader first takes an action, followed by the follower who takes their action after observing the leader's move. The goal of the leader is to learn to minimize the cumulative regret based on the history of interactions. Differing from the traditional formulation of repeated Stackelberg games, we assume the follower is omniscient, with full knowledge of the true reward, and that they always best-respond to the leader's actions. We analyze the sample complexity of regret minimization in this repeated Stackelberg game. We show that depending on the reward structure, the existence of the omniscient follower may change the sample complexity drastically, from constant to exponential, even for linear cooperative Stackelberg games. This poses unique challenges for the learning process of the leader and the subsequent regret analysis.

Wasserstein gradient flows of maximum mean discrepancy (MMD) functionals with non-smooth Riesz kernels show a rich structure as singular measures can become absolutely continuous ones and conversely. In this paper we contribute to the understanding of such flows. We propose to approximate the backward scheme of Jordan, Kinderlehrer and Otto for computing such Wasserstein gradient flows as well as a forward scheme for so-called Wasserstein steepest descent flows by neural networks (NNs). Since we cannot restrict ourselves to absolutely continuous measures, we have to deal with transport plans and velocity plans instead of usual transport maps and velocity fields. Indeed, we approximate the disintegration of both plans by generative NNs which are learned with respect to appropriate loss functions. In order to evaluate the quality of both neural schemes, we benchmark them on the interaction energy. Here we provide analytic formulas for Wasserstein schemes starting at a Dirac measure and show their convergence as the time step size tends to zero. Finally, we illustrate our neural MMD flows by numerical examples.

As previous representations for reinforcement learning cannot effectively incorporate a human-intuitive understanding of the 3D environment, they usually suffer from sub-optimal performances. In this paper, we present Semantic-aware Neural Radiance Fields for Reinforcement Learning (SNeRL), which jointly optimizes semantic-aware neural radiance fields (NeRF) with a convolutional encoder to learn 3D-aware neural implicit representation from multi-view images. We introduce 3D semantic and distilled feature fields in parallel to the RGB radiance fields in NeRF to learn semantic and object-centric representation for reinforcement learning. SNeRL outperforms not only previous pixel-based representations but also recent 3D-aware representations both in model-free and model-based reinforcement learning.  ( 2 min )

Layout design is an important task in various design fields, including user interfaces, document, and graphic design. As this task requires tedious manual effort by designers, prior works have attempted to automate this process using generative models, but commonly fell short of providing intuitive user controls and achieving design objectives. In this paper, we build a conditional latent diffusion model, PLay, that generates parametrically conditioned layouts in vector graphic space from user-specified guidelines, which are commonly used by designers for representing their design intents in current practices. Our method outperforms prior works across three datasets on metrics including FID and FD-VG, and in user test. Moreover, it brings a novel and interactive experience to professional layout design processes.  ( 2 min )

Deep learning methods dominate short-term high-resolution precipitation nowcasting in terms of prediction error. However, their operational usability is limited by difficulties explaining dynamics behind the predictions, which are smoothed out and missing the high-frequency features due to optimizing for mean error loss functions. We experiment with hand-engineering of the advection-diffusion differential equation into a PhyCell to introduce more accurate physical prior to a PhyDNet model that disentangles physical and residual dynamics. Results indicate that while PhyCell can learn the intended dynamics, training of PhyDNet remains driven by loss optimization, resulting in a model with the same prediction capabilities.

Real-world data streams naturally include the repetition of previous concepts. From a Continual Learning (CL) perspective, repetition is a property of the environment and, unlike replay, cannot be controlled by the user. Nowadays, Class-Incremental scenarios represent the leading test-bed for assessing and comparing CL strategies. This family of scenarios is very easy to use, but it never allows revisiting previously seen classes, thus completely disregarding the role of repetition. We focus on the family of Class-Incremental with Repetition (CIR) scenarios, where repetition is embedded in the definition of the stream. We propose two stochastic scenario generators that produce a wide range of CIR scenarios starting from a single dataset and a few control parameters. We conduct the first comprehensive evaluation of repetition in CL by studying the behavior of existing CL strategies under different CIR scenarios. We then present a novel replay strategy that exploits repetition and counteracts the natural imbalance present in the stream. On both CIFAR100 and TinyImageNet, our strategy outperforms other replay approaches, which are not designed for environments with repetition.  ( 2 min )

Physics-based simulation of mesh based domains remains a challenging task. State-of-the-art techniques can produce realistic results but require expert knowledge. A major bottleneck in many approaches is the step of integrating a potential energy in order to compute velocities or displacements. Recently, learning based method for physics-based simulation have sparked interest with graph based approaches being a promising research direction. One of the challenges for these methods is to generate models that are mesh independent and generalize to different material properties. Moreover, the model should also be able to react to unforeseen external forces like ubiquitous collisions. Our contribution is based on a simple observation: evaluating forces is computationally relatively cheap for traditional simulation methods and can be computed in parallel in contrast to their integration. If we learn how a system reacts to forces in general, irrespective of their origin, we can learn an integrator that can predict state changes due to the total forces with high generalization power. We effectively factor out the physical model behind resulting forces by relying on an opaque force module. We demonstrate that this idea leads to a learnable module that can be trained on basic internal forces of small mesh patches and generalizes to different mesh typologies, resolutions, material parameters and unseen forces like collisions at inference time. Our proposed paradigm is general and can be used to model a variety of physical phenomena. We focus our exposition on the detail enhancement of coarse clothing geometry which has many applications including computer games, virtual reality and virtual try-on.  ( 2 min )

Bayesian Optimization Mixed-Precision Neural Architecture Search (BOMP-NAS) is an approach to quantization-aware neural architecture search (QA-NAS) that leverages both Bayesian optimization (BO) and mixed-precision quantization (MP) to efficiently search for compact, high performance deep neural networks. The results show that integrating quantization-aware fine-tuning (QAFT) into the NAS loop is a necessary step to find networks that perform well under low-precision quantization: integrating it allows a model size reduction of nearly 50\% on the CIFAR-10 dataset. BOMP-NAS is able to find neural networks that achieve state of the art performance at much lower design costs. This study shows that BOMP-NAS can find these neural networks at a 6x shorter search time compared to the closest related work.  ( 2 min )

This paper compares the parametric design space with a feature space generated by the extraction of design features using deep learning (DL) as an alternative way for design space exploration. In this comparison, the parametric design space is constructed by creating a synthetic dataset of 15.000 elements using a parametric algorithm and reducing its dimensions for visualization. The feature space - reduced-dimensionality vector space of embedded data features - is constructed by training a DL model on the same dataset. We analyze and compare the extracted design features by reducing their dimension and visualizing the results. We demonstrate that parametric design space is narrow in how it describes the design solutions because it is based on the combination of individual parameters. In comparison, we observed that the feature design space can intuitively represent design solutions according to complex parameter relationships. Based on our results, we discuss the potential of translating the features learned by DL models to provide a mechanism for intuitive design exploration space and visualization of possible design solutions.

We address the problem of learning the dynamics of an unknown non-parametric system linking a target and a feature time series. The feature time series is measured on a sparse and irregular grid, while we have access to only a few points of the target time series. Once learned, we can use these dynamics to predict values of the target from the previous values of the feature time series. We frame this task as learning the solution map of a controlled differential equation (CDE). By leveraging the rich theory of signatures, we are able to cast this non-linear problem as a high-dimensional linear regression. We provide an oracle bound on the prediction error which exhibits explicit dependencies on the individual-specific sampling schemes. Our theoretical results are illustrated by simulations which show that our method outperforms existing algorithms for recovering the full time series while being computationally cheap. We conclude by demonstrating its potential on real-world epidemiological data.  ( 2 min )

Graphs are a natural representation of brain activity derived from functional magnetic imaging (fMRI) data. It is well known that clusters of anatomical brain regions, known as functional connectivity networks (FCNs), encode temporal relationships which can serve as useful biomarkers for understanding brain function and dysfunction. Previous works, however, ignore the temporal dynamics of the brain and focus on static graphs. In this paper, we propose a dynamic brain graph deep generative model (DBGDGM) which simultaneously clusters brain regions into temporally evolving communities and learns dynamic unsupervised node embeddings. Specifically, DBGDGM represents brain graph nodes as embeddings sampled from a distribution over communities that evolve over time. We parameterise this community distribution using neural networks that learn from subject and node embeddings as well as past community assignments. Experiments demonstrate DBGDGM outperforms baselines in graph generation, dynamic link prediction, and is comparable for graph classification. Finally, an analysis of the learnt community distributions reveals overlap with known FCNs reported in neuroscience literature.  ( 2 min )

The Bitcoin cryptocurrency has received much attention recently. In the network of Bitcoin, transactions are recorded in a ledger. In this network, the process of recording transactions depends on some nodes called miners that execute a protocol known as mining protocol. One of the significant aspects of mining protocol is incentive compatibility. However, literature has shown that Bitcoin mining's protocol is not incentive-compatible. Some nodes with high computational power can obtain more revenue than their fair share by adopting a type of attack called the selfish mining attack. In this paper, we propose an artificial intelligence-based defense against selfish mining attacks by applying the theory of learning automata. The proposed defense mechanism ignores private blocks by assigning weight based on block discovery time and changes current Bitcoin's fork resolving policy by evaluating branches' height difference in a self-adaptive manner utilizing learning automata. To the best of our knowledge, the proposed protocol is the literature's first learning-based defense mechanism. Simulation results have shown the superiority of the proposed mechanism against tie-breaking mechanism, which is a well-known defense. The simulation results have shown that the suggested defense mechanism increases the profit threshold up to 40\% and decreases the revenue of selfish attackers.  ( 2 min )

This work establishes rigorous, novel and widely applicable stability guarantees and transferability bounds for graph convolutional networks -- without reference to any underlying limit object or statistical distribution. Crucially, utilized graph-shift operators (GSOs) are not necessarily assumed to be normal, allowing for the treatment of networks on both directed- and for the first time also undirected graphs. Stability to node-level perturbations is related to an 'adequate (spectral) covering' property of the filters in each layer. Stability to edge-level perturbations is related to Lipschitz constants and newly introduced semi-norms of filters. Results on stability to topological perturbations are obtained through recently developed mathematical-physics based tools. As an important and novel example, it is showcased that graph convolutional networks are stable under graph-coarse-graining procedures (replacing strongly-connected sub-graphs by single nodes) precisely if the GSO is the graph Laplacian and filters are regular at infinity. These new theoretical results are supported by corresponding numerical investigations.  ( 2 min )

Multivariate time series (MTS) forecasting has penetrated and benefited our daily life. However, the unfair forecasting of MTSs not only degrades their practical benefit but even brings about serious potential risk. Such unfair MTS forecasting may be attributed to variable disparity leading to advantaged and disadvantaged variables. This issue has rarely been studied in the existing MTS forecasting models. To address this significant gap, we formulate the MTS fairness modeling problem as learning informative representations attending to both advantaged and disadvantaged variables. Accordingly, we propose a novel framework, named FairFor, for fairness-aware MTS forecasting. FairFor is based on adversarial learning to generate both group-irrelevant and -relevant representations for the downstream forecasting. FairFor first adopts the recurrent graph convolution to capture spatio-temporal variable correlations and to group variables by leveraging a spectral relaxation of the K-means objective. Then, it utilizes a novel filtering & fusion module to filter the group-relevant information and generate group-irrelevant representations by orthogonality regularization. The group-irrelevant and -relevant representations form highly informative representations, facilitating to share the knowledge from advantaged variables to disadvantaged variables and guarantee fairness. Extensive experiments on four public datasets demonstrate the FairFor effectiveness for fair forecasting and significant performance improvement.  ( 2 min )

We present a policy optimization framework in which the learned policy comes with a machine-checkable certificate of adversarial robustness. Our approach, called CAROL, learns a model of the environment. In each learning iteration, it uses the current version of this model and an external abstract interpreter to construct a differentiable signal for provable robustness. This signal is used to guide policy learning, and the abstract interpretation used to construct it directly leads to the robustness certificate returned at convergence. We give a theoretical analysis that bounds the worst-case accumulative reward of CAROL. We also experimentally evaluate CAROL on four MuJoCo environments. On these tasks, which involve continuous state and action spaces, CAROL learns certified policies that have performance comparable to the (non-certified) policies learned using state-of-the-art robust RL methods.  ( 2 min )

Low-dose Computed Tomography (LDCT) reconstruction is an important task in medical image analysis. Recent years have seen many deep learning based methods, proved to be effective in this area. However, these methods mostly follow a supervised architecture, which needs paired CT image of full dose and quarter dose, and the solution is highly dependent on specific measurements. In this work, we introduce Denoising Diffusion LDCT Model, dubbed as DDLM, generating noise-free CT image using conditioned sampling. DDLM uses pretrained model, and need no training nor tuning process, thus our proposal is in unsupervised manner. Experiments on LDCT images have shown comparable performance of DDLM using less inference time, surpassing other state-of-the-art methods, proving both accurate and efficient. Implementation code will be set to public soon.  ( 2 min )

Normalizing flows (NF) are a class of powerful generative models that have gained popularity in recent years due to their ability to model complex distributions with high flexibility and expressiveness. In this work, we introduce a new type of normalizing flow that is tailored for modeling positions and orientations of multiple objects in three-dimensional space, such as molecules in a crystal. Our approach is based on two key ideas: first, we define smooth and expressive flows on the group of unit quaternions, which allows us to capture the continuous rotational motion of rigid bodies; second, we use the double cover property of unit quaternions to define a proper density on the rotation group. This ensures that our model can be trained using standard likelihood-based methods or variational inference with respect to a thermodynamic target density. We evaluate the method by training Boltzmann generators for two molecular examples, namely the multi-modal density of a tetrahedral system in an external field and the ice XI phase in the TIP4P-Ew water model. Our flows can be combined with flows operating on the internal degrees of freedom of molecules, and constitute an important step towards the modeling of distributions of many interacting molecules.  ( 2 min )

We introduce a self-learning algorithm for synthesizing programs for OEIS sequences. The algorithm starts from scratch initially generating programs at random. Then it runs many iterations of a self-learning loop that interleaves (i) training neural machine translation to learn the correspondence between sequences and the programs discovered so far, and (ii) proposing many new programs for each OEIS sequence by the trained neural machine translator. The algorithm discovers on its own programs for more than 78000 OEIS sequences, sometimes developing unusual programming methods. We analyze its behavior and the invented programs in several experiments.  ( 2 min )

In this paper, we take a holistic approach to deal with the tradeoffs between energy use and comfort in commercial buildings. We developed a system called OCTOPUS, which employs a novel deep reinforcement learning (DRL) framework that uses a data-driven approach to find the optimal control sequences of all building's subsystems, including HVAC, lighting, blind and window systems. The DRL architecture includes a novel reward function that allows the framework to explore the tradeoffs between energy use and users' comfort, while at the same time enabling the solution of the high-dimensional control problem due to the interactions of four different building subsystems. In order to cope with OCTOPUS's data training requirements, we argue that calibrated simulations that match the target building operational points are the vehicle to generate enough data to be able to train our DRL framework to find the control solution for the target building. In our work, we trained OCTOPUS with 10-year weather data and a building model that is implemented in the EnergyPlus building simulator, which was calibrated using data from a real production building. Through extensive simulations, we demonstrate that OCTOPUS can achieve 14.26% and 8.1% energy savings compared with the state-of-the-art rule-based method in a LEED Gold Certified building and the latest DRL-based method available in the literature respectively, while maintaining human comfort within a desired range.  ( 2 min )

The main goal of machine learning (ML) is to study and improve mathematical models which can be trained with data provided by the environment to infer the future and to make decisions without necessarily having complete knowledge of all influencing elements. In this work, we describe how ML can be a powerful tool in studying climate modeling. Tree ring growth was used as an implementation in different aspects, for example, studying the history of buildings and environment. By growing and via the time, a new layer of wood to beneath its bark by the tree. After years of growing, time series can be applied via a sequence of tree ring widths. The purpose of this paper is to use ML algorithms and Extreme Value Theory in order to analyse a set of tree ring widths data from nine trees growing in Nottinghamshire. Initially, we start by exploring the data through a variety of descriptive statistical approaches. Transforming data is important at this stage to find out any problem in modelling algorithm. We then use algorithm tuning and ensemble methods to improve the k-nearest neighbors (KNN) algorithm. A comparison between the developed method in this study ad other methods are applied. Also, extreme value of the dataset will be more investigated. The results of the analysis study show that the ML algorithms in the Random Forest method would give accurate results in the analysis of tree ring widths data from nine trees growing in Nottinghamshire with the lowest Root Mean Square Error value. Also, we notice that as the assumed ARMA model parameters increased, the probability of selecting the true model also increased. In terms of the Extreme Value Theory, the Weibull distribution would be a good choice to model tree ring data.  ( 2 min )

We study how training molds the Riemannian geometry induced by neural network feature maps. At infinite width, neural networks with random parameters induce highly symmetric metrics on input space. Feature learning in networks trained to perform classification tasks magnifies local areas along decision boundaries. These changes are consistent with previously proposed geometric approaches for hand-tuning of kernel methods to improve generalization.  ( 2 min )

As a few large-scale pre-trained models become the major choices of various applications, new challenges arise for model pruning, e.g., can we avoid pruning the same model from scratch for every downstream task? How to reuse the pruning results of previous tasks to accelerate the pruning for a new task? To address these challenges, we create a small model for a new task from the pruned models of similar tasks. We show that a few fine-tuning steps on this model suffice to produce a promising pruned-model for the new task. We study this ''meta-pruning'' from nearest tasks on two major classes of pre-trained models, convolutional neural network (CNN) and vision transformer (ViT), under a limited budget of pruning iterations. Our study begins by investigating the overlap of pruned models for similar tasks and how the overlap changes over different layers and blocks. Inspired by these discoveries, we develop a simple but effective ''Meta-Vote Pruning (MVP)'' method that significantly reduces the pruning iterations for a new task by initializing a sub-network from the pruned models of its nearest tasks. In experiments, we demonstrate MVP's advantages in accuracy, efficiency, and generalization through extensive empirical studies and comparisons with popular pruning methods over several datasets.  ( 2 min )

We present a model-based offline reinforcement learning policy performance lower bound that explicitly captures dynamics model misspecification and distribution mismatch and we propose an empirical algorithm for optimal offline policy selection. Theoretically, we prove a novel safe policy improvement theorem by establishing pessimism approximations to the value function. Our key insight is to jointly consider selecting over dynamics models and policies: as long as a dynamics model can accurately represent the dynamics of the state-action pairs visited by a given policy, it is possible to approximate the value of that particular policy. We analyze our lower bound in the LQR setting and also show competitive performance to previous lower bounds on policy selection across a set of D4RL tasks.  ( 2 min )

This paper introduces a new parameterization of deep neural networks (both fully-connected and convolutional) with guaranteed Lipschitz bounds, i.e. limited sensitivity to perturbations. The Lipschitz guarantees are equivalent to the tightest-known bounds based on certification via a semidefinite program (SDP), which does not scale to large models. In contrast to the SDP approach, we provide a ``direct'' parameterization, i.e. a smooth mapping from $\mathbb R^N$ onto the set of weights of Lipschitz-bounded networks. This enables training via standard gradient methods, without any computationally intensive projections or barrier terms. The new parameterization can equivalently be thought of as either a new layer type (the \textit{sandwich layer}), or a novel parameterization of standard feedforward networks with parameter sharing between neighbouring layers. We illustrate the method with some applications in image classification (MNIST and CIFAR-10).  ( 2 min )

This work develops a flexible and mathematically sound framework for the design and analysis of graph scattering networks with variable branching ratios and generic functional calculus filters. Spectrally-agnostic stability guarantees for node- and graph-level perturbations are derived; the vertex-set non-preserving case is treated by utilizing recently developed mathematical-physics based tools. Energy propagation through the network layers is investigated and related to truncation stability. New methods of graph-level feature aggregation are introduced and stability of the resulting composite scattering architectures is established. Finally, scattering transforms are extended to edge- and higher order tensorial input. Theoretical results are complemented by numerical investigations: Suitably chosen cattering networks conforming to the developed theory perform better than traditional graph-wavelet based scattering approaches in social network graph classification tasks and significantly outperform other graph-based learning approaches to regression of quantum-chemical energies on QM7.  ( 2 min )

Domain decomposition methods (DDMs) are popular solvers for discretized systems of partial differential equations (PDEs), with one-level and multilevel variants. These solvers rely on several algorithmic and mathematical parameters, prescribing overlap, subdomain boundary conditions, and other properties of the DDM. While some work has been done on optimizing these parameters, it has mostly focused on the one-level setting or special cases such as structured-grid discretizations with regular subdomain construction. In this paper, we propose multigrid graph neural networks (MG-GNN), a novel GNN architecture for learning optimized parameters in two-level DDMs\@. We train MG-GNN using a new unsupervised loss function, enabling effective training on small problems that yields robust performance on unstructured grids that are orders of magnitude larger than those in the training set. We show that MG-GNN outperforms popular hierarchical graph network architectures for this optimization and that our proposed loss function is critical to achieving this improved performance.  ( 2 min )

Modern CNNs are learning the weights of vast numbers of convolutional operators. In this paper, we raise the fundamental question if this is actually necessary. We show that even in the extreme case of only randomly initializing and never updating spatial filters, certain CNN architectures can be trained to surpass the accuracy of standard training. By reinterpreting the notion of pointwise ($1\times 1$) convolutions as an operator to learn linear combinations (LC) of frozen (random) spatial filters, we are able to analyze these effects and propose a generic LC convolution block that allows tuning of the linear combination rate. Empirically, we show that this approach not only allows us to reach high test accuracies on CIFAR and ImageNet but also has favorable properties regarding model robustness, generalization, sparsity, and the total number of necessary weights. Additionally, we propose a novel weight sharing mechanism, which allows sharing of a single weight tensor between all spatial convolution layers to massively reduce the number of weights.  ( 2 min )

Over the past few decades, a number of methods have been proposed for causal effect estimation, yet few have been demonstrated to be effective in handling data with complex structures, such as images. To fill this gap, we propose a Causal Multi-task Deep Ensemble (CMDE) framework to learn both shared and group-specific information from the study population and prove its equivalence to a multi-task Gaussian process (GP) with coregionalization kernel a priori. Compared to multi-task GP, CMDE efficiently handles high-dimensional and multi-modal covariates and provides pointwise uncertainty estimates of causal effects. We evaluate our method across various types of datasets and tasks and find that CMDE outperforms state-of-the-art methods on a majority of these tasks.  ( 2 min )

We propose a novel machine learning method based on differentiable vortex particles to infer and predict fluid dynamics from a single video. The key design of our system is a particle-based latent space to encapsulate the hidden, Lagrangian vortical evolution underpinning the observable, Eulerian flow phenomena. We devise a novel differentiable vortex particle system in conjunction with their learnable, vortex-to-velocity dynamics mapping to effectively capture and represent the complex flow features in a reduced space. We further design an end-to-end training pipeline to directly learn and synthesize simulators from data, that can reliably deliver future video rollouts based on limited observation. The value of our method is twofold: first, our learned simulator enables the inference of hidden physics quantities (e.g. velocity field) purely from visual observation, to be used for motion analysis; secondly, it also supports future prediction, constructing the input video's sequel along with its future dynamics evolution. We demonstrate our method's efficacy by comparing quantitatively and qualitatively with a range of existing methods on both synthetic and real-world videos, displaying improved data correspondence, visual plausibility, and physical integrity.  ( 2 min )

Maximization of mutual information between the model's input and output is formally related to "decisiveness" and "fairness" of the softmax predictions, motivating such unsupervised entropy-based losses for discriminative neural networks. Recent self-labeling methods based on such losses represent the state of the art in deep clustering. However, some important properties of entropy clustering are not well-known, or even misunderstood. For example, we provide a counterexample to prior claims about equivalence to variance clustering (K-means) and point out technical mistakes in such theories. We discuss the fundamental differences between these discriminative and generative clustering approaches. Moreover, we show the susceptibility of standard entropy clustering to narrow margins and motivate an explicit margin maximization term. We also propose an improved self-labeling loss; it is robust to pseudo-labeling errors and enforces stronger fairness. We develop an EM algorithm for our loss that is significantly faster than the standard alternatives. Our results improve the state-of-the-art on standard benchmarks.  ( 2 min )

Brain tumors are one of the life-threatening forms of cancer. Previous studies have classified brain tumors using deep neural networks. In this paper, we perform the later task using a collaborative deep learning technique, more specifically split learning. Split learning allows collaborative learning via neural networks splitting into two (or more) parts, a client-side network and a server-side network. The client-side is trained to a certain layer called the cut layer. Then, the rest of the training is resumed on the server-side network. Vertical distribution, a method for distributing data among organizations, was implemented where several hospitals hold different attributes of information for the same set of patients. To the best of our knowledge this paper will be the first paper to implement both split learning and vertical distribution for brain tumor classification. Using both techniques, we were able to achieve train and test accuracy greater than 90\% and 70\%, respectively.  ( 2 min )

Recently, remarkable progress has been made by approximating Nash equilibrium (NE), correlated equilibrium (CE), and coarse correlated equilibrium (CCE) through function approximation that trains a neural network to predict equilibria from game representations. Furthermore, equivariant architectures are widely adopted in designing such equilibrium approximators in normal-form games. In this paper, we theoretically characterize benefits and limitations of equivariant equilibrium approximators. For the benefits, we show that they enjoy better generalizability than general ones and can achieve better approximations when the payoff distribution is permutation-invariant. For the limitations, we discuss their drawbacks in terms of equilibrium selection and social welfare. Together, our results help to understand the role of equivariance in equilibrium approximators.  ( 2 min )

It is believed that Gradient Descent (GD) induces an implicit bias towards good generalization in training machine learning models. This paper provides a fine-grained analysis of the dynamics of GD for the matrix sensing problem, whose goal is to recover a low-rank ground-truth matrix from near-isotropic linear measurements. It is shown that GD with small initialization behaves similarly to the greedy low-rank learning heuristics (Li et al., 2020) and follows an incremental learning procedure (Gissin et al., 2019): GD sequentially learns solutions with increasing ranks until it recovers the ground truth matrix. Compared to existing works which only analyze the first learning phase for rank-1 solutions, our result provides characterizations for the whole learning process. Moreover, besides the over-parameterized regime that many prior works focused on, our analysis of the incremental learning procedure also applies to the under-parameterized regime. Finally, we conduct numerical experiments to confirm our theoretical findings.  ( 2 min )

Recent techniques that integrate \emph{solver layers} into Deep Neural Networks (DNNs) have shown promise in bridging a long-standing gap between inductive learning and symbolic reasoning techniques. In this paper we present a set of techniques for integrating \emph{Satisfiability Modulo Theories} (SMT) solvers into the forward and backward passes of a deep network layer, called SMTLayer. Using this approach, one can encode rich domain knowledge into the network in the form of mathematical formulas. In the forward pass, the solver uses symbols produced by prior layers, along with these formulas, to construct inferences; in the backward pass, the solver informs updates to the network, driving it towards representations that are compatible with the solver's theory. Notably, the solver need not be differentiable. We implement \layername as a Pytorch module, and our empirical results show that it leads to models that \emph{1)} require fewer training samples than conventional models, \emph{2)} that are robust to certain types of covariate shift, and \emph{3)} that ultimately learn representations that are consistent with symbolic knowledge, and thus naturally interpretable.  ( 2 min )

Structural learning, which aims to learn directed acyclic graphs (DAGs) from observational data, is foundational to causal reasoning and scientific discovery. Recent advancements formulate structural learning into a continuous optimization problem; however, DAG learning remains a highly non-convex problem, and there has not been much work on leveraging well-developed convex optimization techniques for causal structural learning. We fill this gap by proposing a data-adaptive linear approach for causal structural learning from time series data, which can be conveniently cast into a convex optimization problem using a recently developed monotone operator variational inequality (VI) formulation. Furthermore, we establish non-asymptotic recovery guarantee of the VI-based approach and show the superior performance of our proposed method on structure recovery over existing methods via extensive numerical experiments.  ( 2 min )

The recent discovery of the equivalence between infinitely wide neural networks (NNs) in the lazy training regime and Neural Tangent Kernels (NTKs) (Jacot et al., 2018) has revived interest in kernel methods. However, conventional wisdom suggests kernel methods are unsuitable for large samples due to their computational complexity and memory requirements. We introduce a novel random feature regression algorithm that allows us (when necessary) to scale to virtually infinite numbers of random features. We illustrate the performance of our method on the CIFAR-10 dataset.  ( 2 min )

Anomaly detection is an important task for complex systems (e.g., industrial facilities, manufacturing, large-scale science experiments), where failures in a sub-system can lead to low yield, faulty products, or even damage to components. While complex systems often have a wealth of data, labeled anomalies are typically rare (or even nonexistent) and expensive to acquire. In this paper, we introduce a new method, called CoAD, for training anomaly detection models on unlabeled data, based on the expectation that anomalous behavior in one sub-system will produce coincident anomalies in downstream sub-systems and products. Given data split into two streams $s$ and $q$ (i.e., subsystem diagnostics and final product quality), we define an unsupervised metric, $\hat{F}_\beta$, out of analogy to the supervised classification $F_\beta$ statistic, which quantifies the performance of the independent anomaly detection algorithms on s and q based on their coincidence rate. We demonstrate our method in four cases: a synthetic time-series data set, a synthetic imaging data set generated from MNIST, a metal milling data set, and a data set taken from a particle accelerator.  ( 2 min )

We study the causal bandit problem when the causal graph is unknown and develop an efficient algorithm for finding the parent node of the reward node using atomic interventions. We derive the exact equation for the expected number of interventions performed by the algorithm and show that under certain graphical conditions it could perform either logarithmically fast or, under more general assumptions, slower but still sublinearly in the number of variables. We formally show that our algorithm is optimal as it meets the universal lower bound we establish for any algorithm that performs atomic interventions. Finally, we extend our algorithm to the case when the reward node has multiple parents. Using this algorithm together with a standard algorithm from bandit literature leads to improved regret bounds.  ( 2 min )

One of the most challenging and consequential problems in climate modeling is to provide probabilistic projections of sea level rise. A large part of the uncertainty of sea level projections is due to uncertainty in ice sheet dynamics. At the moment, accurate quantification of the uncertainty is hindered by the cost of ice sheet computational models. In this work, we develop a hybrid approach to approximate existing ice sheet computational models at a fraction of their cost. Our approach consists of replacing the finite element model for the momentum equations for the ice velocity, the most expensive part of an ice sheet model, with a Deep Operator Network, while retaining a classic finite element discretization for the evolution of the ice thickness. We show that the resulting hybrid model is very accurate and it is an order of magnitude faster than the traditional finite element model. Further, a distinctive feature of the proposed model compared to other neural network approaches, is that it can handle high-dimensional parameter spaces (parameter fields) such as the basal friction at the bed of the glacier, and can therefore be used for generating samples for uncertainty quantification. We study the impact of hyper-parameters, number of unknowns and correlation length of the parameter distribution on the training and accuracy of the Deep Operator Network on a synthetic ice sheet model. We then target the evolution of the Humboldt glacier in Greenland and show that our hybrid model can provide accurate statistics of the glacier mass loss and can be effectively used to accelerate the quantification of uncertainty.  ( 2 min )

We theoretically study the impact of differential privacy on fairness in classification. We prove that, given a class of models, popular group fairness measures are pointwise Lipschitz-continuous with respect to the parameters of the model. This result is a consequence of a more general statement on accuracy conditioned on an arbitrary event (such as membership to a sensitive group), which may be of independent interest. We use the aforementioned Lipschitz property to prove a high probability bound showing that, given enough examples, the fairness level of private models is close to the one of their non-private counterparts.

To provide rigorous uncertainty quantification for online learning models, we develop a framework for constructing uncertainty sets that provably control risk -- such as coverage of confidence intervals, false negative rate, or F1 score -- in the online setting. This extends conformal prediction to apply to a larger class of online learning problems. Our method guarantees risk control at any user-specified level even when the underlying data distribution shifts drastically, even adversarially, over time in an unknown fashion. The technique we propose is highly flexible as it can be applied with any base online learning algorithm (e.g., a deep neural network trained online), requiring minimal implementation effort and essentially zero additional computational cost. We further extend our approach to control multiple risks simultaneously, so the prediction sets we generate are valid for all given risks. To demonstrate the utility of our method, we conduct experiments on real-world tabular time-series data sets showing that the proposed method rigorously controls various natural risks. Furthermore, we show how to construct valid intervals for an online image-depth estimation problem that previous sequential calibration schemes cannot handle.  ( 2 min )

Stochastic versions of proximal methods have gained much attention in statistics and machine learning. These algorithms tend to admit simple, scalable forms, and enjoy numerical stability via implicit updates. In this work, we propose and analyze a stochastic version of the recently proposed proximal distance algorithm, a class of iterative optimization methods that recover a desired constrained estimation problem as a penalty parameter $\rho \rightarrow \infty$. By uncovering connections to related stochastic proximal methods and interpreting the penalty parameter as the learning rate, we justify heuristics used in practical manifestations of the proximal distance method, establishing their convergence guarantees for the first time. Moreover, we extend recent theoretical devices to establish finite error bounds and a complete characterization of convergence rates regimes. We validate our analysis via a thorough empirical study, also showing that unsurprisingly, the proposed method outpaces batch versions on popular learning tasks.

How to do big portfolio selection is very important but challenging for both researchers and practitioners. In this paper, we propose a new graph-based conditional moments (GRACE) method to do portfolio selection based on thousands of stocks or more. The GRACE method first learns the conditional quantiles and mean of stock returns via a factor-augmented temporal graph convolutional network, which guides the learning procedure through a factor-hypergraph built by the set of stock-to-stock relations from the domain knowledge as well as the set of factor-to-stock relations from the asset pricing knowledge. Next, the GRACE method learns the conditional variance, skewness, and kurtosis of stock returns from the learned conditional quantiles by using the quantiled conditional moment (QCM) method. The QCM method is a supervised learning procedure to learn these conditional higher-order moments, so it largely overcomes the computational difficulty from the classical high-dimensional GARCH-type methods. Moreover, the QCM method allows the mis-specification in modeling conditional quantiles to some extent, due to its regression-based nature. Finally, the GRACE method uses the learned conditional mean, variance, skewness, and kurtosis to construct several performance measures, which are criteria to sort the stocks to proceed the portfolio selection in the well-known 10-decile framework. An application to NASDAQ and NYSE stock markets shows that the GRACE method performs much better than its competitors, particularly when the performance measures are comprised of conditional variance, skewness, and kurtosis.  ( 2 min )

Most personalised federated learning (FL) approaches assume that raw data of all clients are defined in a common subspace i.e. all clients store their data according to the same schema. For real-world applications, this assumption is restrictive as clients, having their own systems to collect and then store data, may use heterogeneous data representations. We aim at filling this gap. To this end, we propose a general framework coined FLIC that maps client's data onto a common feature space via local embedding functions. The common feature space is learnt in a federated manner using Wasserstein barycenters while the local embedding functions are trained on each client via distribution alignment. We integrate this distribution alignement mechanism into a federated learning approach and provide the algorithmics of FLIC. We compare its performances against FL benchmarks involving heterogeneous input features spaces. In addition, we provide theoretical insights supporting the relevance of our methodology.  ( 2 min )

In this work, we present an analysis of the generalization of Neural Operators (NOs) and derived architectures. We proposed a family of networks, which we name (${\textit{s}}{\text{NO}}+\varepsilon$), where we modify the layout of NOs towards an architecture resembling a Transformer; mainly, we substitute the Attention module with the Integral Operator part of NOs. The resulting network preserves universality, has a better generalization to unseen data, and similar number of parameters as NOs. On the one hand, we study numerically the generalization by gradually transforming NOs into ${\textit{s}}{\text{NO}}+\varepsilon$ and verifying a reduction of the test loss considering a time-harmonic wave dataset with different frequencies. We perform the following changes in NOs: (a) we split the Integral Operator (non-local) and the (local) feed-forward network (MLP) into different layers, generating a {\it sequential} structure which we call sequential Neural Operator (${\textit{s}}{\text{NO}}$), (b) we add the skip connection, and layer normalization in ${\textit{s}}{\text{NO}}$, and (c) we incorporate dropout and stochastic depth that allows us to generate deep networks. In each case, we observe a decrease in the test loss in a wide variety of initialization, indicating that our changes outperform the NO. On the other hand, building on infinite-dimensional Statistics, and in particular the Dudley Theorem, we provide bounds of the Rademacher complexity of NOs and ${\textit{s}}{\text{NO}}$, and we find the following relationship: the upper bound of the Rademacher complexity of the ${\textit{s}}{\text{NO}}$ is a lower-bound of the NOs, thereby, the generalization error bound of ${\textit{s}}{\text{NO}}$ is smaller than NO, which further strengthens our numerical results.  ( 2 min )

Explainability has become a central requirement for the development, deployment, and adoption of machine learning (ML) models and we are yet to understand what explanation methods can and cannot do. Several factors such as data, model prediction, hyperparameters used in training the model, and random initialization can all influence downstream explanations. While previous work empirically hinted that explanations (E) may have little relationship with the prediction (Y), there is a lack of conclusive study to quantify this relationship. Our work borrows tools from causal inference to systematically assay this relationship. More specifically, we measure the relationship between E and Y by measuring the treatment effect when intervening on their causal ancestors (hyperparameters) (inputs to generate saliency-based Es or Ys). We discover that Y's relative direct influence on E follows an odd pattern; the influence is higher in the lowest-performing models than in mid-performing models, and it then decreases in the top-performing models. We believe our work is a promising first step towards providing better guidance for practitioners who can make more informed decisions in utilizing these explanations by knowing what factors are at play and how they relate to their end task.  ( 2 min )

Batch Bayesian optimisation (BO) has shown to be a sample-efficient method of performing optimisation where expensive-to-evaluate objective functions can be queried in parallel. However, current methods do not scale to large batch sizes -- a frequent desideratum in practice (e.g. drug discovery or simulation-based inference). We present a novel algorithm, SOBER, which permits scalable and diversified batch BO with arbitrary acquisition functions, arbitrary input spaces (e.g. graph), and arbitrary kernels. The key to our approach is to reformulate batch selection for BO as a Bayesian quadrature (BQ) problem, which offers computational advantages. This reformulation is beneficial in solving BQ tasks reciprocally, which introduces the exploitative functionality of BO to BQ. We show that SOBER offers substantive performance gains in synthetic and real-world tasks, including drug discovery and simulation-based inference.  ( 2 min )

Modern approaches to supervised learning like deep neural networks (DNNs) typically implicitly assume that observed responses are statistically independent. In contrast, correlated data are prevalent in real-life large-scale applications, with typical sources of correlation including spatial, temporal and clustering structures. These correlations are either ignored by DNNs, or ad-hoc solutions are developed for specific use cases. We propose to use the mixed models framework to handle correlated data in DNNs. By treating the effects underlying the correlation structure as random effects, mixed models are able to avoid overfitted parameter estimates and ultimately yield better predictive performance. The key to combining mixed models and DNNs is using the Gaussian negative log-likelihood (NLL) as a natural loss function that is minimized with DNN machinery including stochastic gradient descent (SGD). Since NLL does not decompose like standard DNN loss functions, the use of SGD with NLL presents some theoretical and implementation challenges, which we address. Our approach which we call LMMNN is demonstrated to improve performance over natural competitors in various correlation scenarios on diverse simulated and real datasets. Our focus is on a regression setting and tabular datasets, but we also show some results for classification. Our code is available at https://github.com/gsimchoni/lmmnn.  ( 2 min )

Though anomaly detection (AD) can be viewed as a classification problem (nominal vs. anomalous) it is usually treated in an unsupervised manner since one typically does not have access to, or it is infeasible to utilize, a dataset that sufficiently characterizes what it means to be "anomalous." In this paper we present results demonstrating that this intuition surprisingly seems not to extend to deep AD on images. For a recent AD benchmark on ImageNet, classifiers trained to discern between normal samples and just a few (64) random natural images are able to outperform the current state of the art in deep AD. Experimentally we discover that the multiscale structure of image data makes example anomalies exceptionally informative.  ( 2 min )

Actor-critic methods have achieved significant success in many challenging applications. However, its finite-time convergence is still poorly understood in its most practical form. Existing works on analyzing single-timescale actor-critic only focus on the i.i.d. sampling or tabular setting for simplicity. We consider the more practical online single-timescale actor-critic algorithm on continuous state space, where the critic is updated with a single Markovian sample per actor step. Existing analysis cannot conclude the convergence for such a challenging case. We prove that the online single-timescale actor-critic method is guaranteed to find an $\epsilon$-approximate stationary point with $\widetilde{\mathcal{O}}(\epsilon^{-2})$ sample complexity under standard assumptions, which can be further improved to $\mathcal{O}(\epsilon^{-2})$ under the i.i.d. sampling. We develop a novel framework that evaluates and controls the error propagation between actor and critic systematically. To our knowledge, this is the first finite-time analysis for the online single-timescale actor-critic method. Our results compare favorably to the existing literature in terms of considering the most practical yet challenging settings and requiring weaker assumptions.  ( 2 min )

Heavy-tail phenomena in stochastic gradient descent (SGD) have been reported in several empirical studies. Experimental evidence in previous works suggests a strong interplay between the heaviness of the tails and generalization behavior of SGD. To address this empirical phenomena theoretically, several works have made strong topological and statistical assumptions to link the generalization error to heavy tails. Very recently, new generalization bounds have been proven, indicating a non-monotonic relationship between the generalization error and heavy tails, which is more pertinent to the reported empirical observations. While these bounds do not require additional topological assumptions given that SGD can be modeled using a heavy-tailed stochastic differential equation (SDE), they can only apply to simple quadratic problems. In this paper, we build on this line of research and develop generalization bounds for a more general class of objective functions, which includes non-convex functions as well. Our approach is based on developing Wasserstein stability bounds for heavy-tailed SDEs and their discretizations, which we then convert to generalization bounds. Our results do not require any nontrivial assumptions; yet, they shed more light to the empirical observations, thanks to the generality of the loss functions.  ( 2 min )

Early stopping based on hold-out data is a popular regularization technique designed to mitigate overfitting and increase the predictive accuracy of neural networks. Models trained with early stopping often provide relatively accurate predictions, but they generally still lack precise statistical guarantees unless they are further calibrated using independent hold-out data. This paper addresses the above limitation with conformalized early stopping: a novel method that combines early stopping with conformal calibration while efficiently recycling the same hold-out data. This leads to models that are both accurate and able to provide exact predictive inferences without multiple data splits nor overly conservative adjustments. Practical implementations are developed for different learning tasks -- outlier detection, multi-class classification, regression -- and their competitive performance is demonstrated on real data.  ( 2 min )

We consider a multi-agent multi-armed bandit setting in which $n$ honest agents collaborate over a network to minimize regret but $m$ malicious agents can disrupt learning arbitrarily. Assuming the network is the complete graph, existing algorithms incur $O( (m + K/n) \log (T) / \Delta )$ regret in this setting, where $K$ is the number of arms and $\Delta$ is the arm gap. For $m \ll K$, this improves over the single-agent baseline regret of $O(K\log(T)/\Delta)$. In this work, we show the situation is murkier beyond the case of a complete graph. In particular, we prove that if the state-of-the-art algorithm is used on the undirected line graph, honest agents can suffer (nearly) linear regret until time is doubly exponential in $K$ and $n$. In light of this negative result, we propose a new algorithm for which the $i$-th agent has regret $O( ( d_{\text{mal}}(i) + K/n) \log(T)/\Delta)$ on any connected and undirected graph, where $d_{\text{mal}}(i)$ is the number of $i$'s neighbors who are malicious. Thus, we generalize existing regret bounds beyond the complete graph (where $d_{\text{mal}}(i) = m$), and show the effect of malicious agents is entirely local (in the sense that only the $d_{\text{mal}}(i)$ malicious agents directly connected to $i$ affect its long-term regret).  ( 2 min )

Among the reasons hindering reinforcement learning (RL) applications to real-world problems, two factors are critical: limited data and the mismatch between the testing environment (real environment in which the policy is deployed) and the training environment (e.g., a simulator). This paper attempts to address these issues simultaneously with distributionally robust offline RL, where we learn a distributionally robust policy using historical data obtained from the source environment by optimizing against a worst-case perturbation thereof. In particular, we move beyond tabular settings and consider linear function approximation. More specifically, we consider two settings, one where the dataset is well-explored and the other where the dataset has sufficient coverage of the optimal policy. We propose two algorithms~-- one for each of the two settings~-- that achieve error bounds $\tilde{O}(d^{1/2}/N^{1/2})$ and $\tilde{O}(d^{3/2}/N^{1/2})$ respectively, where $d$ is the dimension in the linear function approximation and $N$ is the number of trajectories in the dataset. To the best of our knowledge, they provide the first non-asymptotic results of the sample complexity in this setting. Diverse experiments are conducted to demonstrate our theoretical findings, showing the superiority of our algorithm against the non-robust one.  ( 2 min )

We study statistical inference on the similarity/distance between two time-series under uncertain environment by considering a statistical hypothesis test on the distance obtained from Dynamic Time Warping (DTW) algorithm. The sampling distribution of the DTW distance is too difficult to derive because it is obtained based on the solution of the DTW algorithm, which is complicated. To circumvent this difficulty, we propose to employ the conditional selective inference framework, which enables us to derive a valid inference method on the DTW distance. To our knowledge, this is the first method that can provide a valid p-value to quantify the statistical significance of the DTW distance, which is helpful for high-stake decision making such as abnormal time-series detection problems. We evaluate the performance of the proposed inference method on both synthetic and real-world datasets.  ( 2 min )

We address the problem of learning the dynamics of an unknown non-parametric system linking a target and a feature time series. The feature time series is measured on a sparse and irregular grid, while we have access to only a few points of the target time series. Once learned, we can use these dynamics to predict values of the target from the previous values of the feature time series. We frame this task as learning the solution map of a controlled differential equation (CDE). By leveraging the rich theory of signatures, we are able to cast this non-linear problem as a high-dimensional linear regression. We provide an oracle bound on the prediction error which exhibits explicit dependencies on the individual-specific sampling schemes. Our theoretical results are illustrated by simulations which show that our method outperforms existing algorithms for recovering the full time series while being computationally cheap. We conclude by demonstrating its potential on real-world epidemiological data.  ( 2 min )

Transfer learning is an emerging and popular paradigm for utilizing existing knowledge from previous learning tasks to improve the performance of new ones. Despite its numerous empirical successes, theoretical analysis for transfer learning is limited. In this paper we build for the first time, to the best of our knowledge, a mathematical framework for the general procedure of transfer learning. Our unique reformulation of transfer learning as an optimization problem allows for the first time, analysis of its feasibility. Additionally, we propose a novel concept of transfer risk to evaluate transferability of transfer learning. Our numerical studies using the Office-31 dataset demonstrate the potential and benefits of incorporating transfer risk in the evaluation of transfer learning performance.  ( 2 min )

As a framework for sequential decision-making, Reinforcement Learning (RL) has been regarded as an essential component leading to Artificial General Intelligence (AGI). However, RL is often criticized for having the same training environment as the test one, which also hinders its application in the real world. To mitigate this problem, Distributionally Robust RL (DRRL) is proposed to improve the worst performance in a set of environments that may contain the unknown test environment. Due to the nonlinearity of the robustness goal, most of the previous work resort to the model-based approach, learning with either an empirical distribution learned from the data or a simulator that can be sampled infinitely, which limits their applications in simple dynamics environments. In contrast, we attempt to design a DRRL algorithm that can be trained along a single trajectory, i.e., no repeated sampling from a state. Based on the standard Q-learning, we propose distributionally robust Q-learning with the single trajectory (DRQ) and its average-reward variant named differential DRQ. We provide asymptotic convergence guarantees and experiments for both settings, demonstrating their superiority in the perturbed environments against the non-robust ones.  ( 2 min )

We examine the problem of obtaining fair outcomes for individuals who choose to share optional information with machine-learned models and those who do not consent and keep their data undisclosed. We find that these non-consenting users receive significantly lower prediction outcomes than justified by their provided information alone. This observation gives rise to the overlooked problem of how to ensure that users, who protect their personal data, are not penalized. While statistical fairness notions focus on fair outcomes between advantaged and disadvantaged groups, these fairness notions fail to protect the non-consenting users. To address this problem, we formalize protection requirements for models which (i) allow users to benefit from sharing optional information and (ii) do not penalize them if they keep their data undisclosed. We offer the first solution to this problem by proposing the notion of Optional Feature Fairness (OFF), which we prove to be loss-optimal under our protection requirements (i) and (ii). To learn OFF-compliant models, we devise a model-agnostic data augmentation strategy with finite sample convergence guarantees. Finally, we extensively analyze OFF on a variety of challenging real-world tasks, models, and data sets with multiple optional features.  ( 2 min )

Bi-stochastic normalization provides an alternative normalization of graph Laplacians in graph-based data analysis and can be computed efficiently by Sinkhorn-Knopp (SK) iterations. This paper proves the convergence of bi-stochastically normalized graph Laplacian to manifold (weighted-)Laplacian with rates, when $n$ data points are i.i.d. sampled from a general $d$-dimensional manifold embedded in a possibly high-dimensional space. Under certain joint limit of $n \to \infty$ and kernel bandwidth $\epsilon \to 0$, the point-wise convergence rate of the graph Laplacian operator (under 2-norm) is proved to be $ O( n^{-1/(d/2+3)})$ at finite large $n$ up to log factors, achieved at the scaling of $\epsilon \sim n^{-1/(d/2+3)} $. When the manifold data are corrupted by outlier noise, we theoretically prove the graph Laplacian point-wise consistency which matches the rate for clean manifold data plus an additional term proportional to the boundedness of the inner-products of the noise vectors among themselves and with data vectors. Motivated by our analysis, which suggests that not exact bi-stochastic normalization but an approximate one will achieve the same consistency rate, we propose an approximate and constrained matrix scaling problem that can be solved by SK iterations with early termination. Numerical experiments support our theoretical results and show the robustness of bi-stochastically normalized graph Laplacian to high-dimensional outlier noise.  ( 2 min )

Variational autoencoders (VAEs) are a popular framework for modeling complex data distributions; they can be efficiently trained via variational inference by maximizing the evidence lower bound (ELBO), at the expense of a gap to the exact (log-)marginal likelihood. While VAEs are commonly used for representation learning, it is unclear why ELBO maximization would yield useful representations, since unregularized maximum likelihood estimation cannot invert the data-generating process. Yet, VAEs often succeed at this task. We seek to elucidate this apparent paradox by studying nonlinear VAEs in the limit of near-deterministic decoders. We first prove that, in this regime, the optimal encoder approximately inverts the decoder -- a commonly used but unproven conjecture -- which we refer to as {\em self-consistency}. Leveraging self-consistency, we show that the ELBO converges to a regularized log-likelihood. This allows VAEs to perform what has recently been termed independent mechanism analysis (IMA): it adds an inductive bias towards decoders with column-orthogonal Jacobians, which helps recovering the true latent factors. The gap between ELBO and log-likelihood is therefore welcome, since it bears unanticipated benefits for nonlinear representation learning. In experiments on synthetic and image data, we show that VAEs uncover the true latent factors when the data generating process satisfies the IMA assumption.  ( 2 min )

In this paper, we present a unified and general framework for analyzing the batch updating approach to nonlinear, high-dimensional optimization. The framework encompasses all the currently used batch updating approaches, and is applicable to nonconvex as well as convex functions. Moreover, the framework permits the use of noise-corrupted gradients, as well as first-order approximations to the gradient (sometimes referred to as "gradient-free" approaches). By viewing the analysis of the iterations as a problem in the convergence of stochastic processes, we are able to establish a very general theorem, which includes most known convergence results for zeroth-order and first-order methods. The analysis of "second-order" or momentum-based methods is not a part of this paper, and will be studied elsewhere. However, numerical experiments indicate that momentum-based methods can fail if the true gradient is replaced by its first-order approximation. This requires further theoretical analysis.  ( 2 min )

Large language models (LLMs) have displayed an impressive ability to harness natural language to perform complex tasks. In this work, we explore whether we can leverage this learned ability to find and explain patterns in data. Specifically, given a pre-trained LLM and data examples, we introduce interpretable autoprompting (iPrompt), an algorithm that generates a natural-language string explaining the data. iPrompt iteratively alternates between generating explanations with an LLM and reranking them based on their performance when used as a prompt. Experiments on a wide range of datasets, from synthetic mathematics to natural-language understanding, show that iPrompt can yield meaningful insights by accurately finding groundtruth dataset descriptions. Moreover, the prompts produced by iPrompt are simultaneously human-interpretable and highly effective for generalization: on real-world sentiment classification datasets, iPrompt produces prompts that match or even improve upon human-written prompts for GPT-3. Finally, experiments with an fMRI dataset show the potential for iPrompt to aid in scientific discovery. All code for using the methods and data here is made available on Github.  ( 2 min )

Bayesian model comparison (BMC) offers a principled approach for assessing the relative merits of competing computational models and propagating uncertainty into model selection decisions. However, BMC is often intractable for the popular class of hierarchical models due to their high-dimensional nested parameter structure. To address this intractability, we propose a deep learning method for performing BMC on any set of hierarchical models which can be instantiated as probabilistic programs. Since our method enables amortized inference, it allows efficient re-estimation of posterior model probabilities and fast performance validation prior to any real-data application. In a series of extensive validation studies, we benchmark the performance of our method against the state-of-the-art bridge sampling method and demonstrate excellent amortized inference across all BMC settings. We then use our method to compare four hierarchical evidence accumulation models that have previously been deemed intractable for BMC due to partly implicit likelihoods. In this application, we corroborate evidence for the recently proposed L\'evy flight model of decision-making and show how transfer learning can be leveraged to enhance training efficiency. Reproducible code for all analyses is provided.  ( 2 min )

Real-world data for classification is often labeled by multiple annotators. For analyzing such data, we introduce CROWDLAB, a straightforward approach to utilize any trained classifier to estimate: (1) A consensus label for each example that aggregates the available annotations; (2) A confidence score for how likely each consensus label is correct; (3) A rating for each annotator quantifying the overall correctness of their labels. Existing algorithms to estimate related quantities in crowdsourcing often rely on sophisticated generative models with iterative inference. CROWDLAB instead uses a straightforward weighted ensemble. Existing algorithms often rely solely on annotator statistics, ignoring the features of the examples from which the annotations derive. CROWDLAB utilizes any classifier model trained on these features, and can thus better generalize between examples with similar features. On real-world multi-annotator image data, our proposed method provides superior estimates for (1)-(3) than existing algorithms like Dawid-Skene/GLAD.  ( 2 min )

Suppose there are $N$ units and $D$ interventions. We aim to learn the average potential outcome associated with every unit-intervention pair, i.e., $N \times D$ causal parameters. While running $N \times D$ experiments is conceivable, it can be expensive or infeasible. This work introduces an experiment design, synthetic A/B testing, and the synthetic interventions (SI) estimator to recover all $N \times D$ causal parameters while observing each unit under at most two interventions, independent of $D$. Under a novel tensor factor model for potential outcomes across units, measurements, and interventions, we establish the identification of each parameter. Further, we show the SI estimator is finite-sample consistent and asymptotically normal. Collectively, these also lead to novel results for panel data settings, particularly for synthetic controls. We empirically validate our experiment design using real e-commerce data from a large-scale A/B test.  ( 2 min )

We propose a goodness-of-fit measure for probability densities modeling observations with varying dimensionality, such as text documents of differing lengths or variable-length sequences. The proposed measure is an instance of the kernel Stein discrepancy (KSD), which has been used to construct goodness-of-fit tests for unnormalized densities. The KSD is defined by its Stein operator: current operators used in testing apply to fixed-dimensional spaces. As our main contribution, we extend the KSD to the variable-dimension setting by identifying appropriate Stein operators, and propose a novel KSD goodness-of-fit test. As with the previous variants, the proposed KSD does not require the density to be normalized, allowing the evaluation of a large class of models. Our test is shown to perform well in practice on discrete sequential data benchmarks.  ( 2 min )

Personalised federated learning (FL) aims at collaboratively learning a machine learning model taylored for each client. Albeit promising advances have been made in this direction, most of existing approaches works do not allow for uncertainty quantification which is crucial in many applications. In addition, personalisation in the cross-device setting still involves important issues, especially for new clients or those having small number of observations. This paper aims at filling these gaps. To this end, we propose a novel methodology coined FedPop by recasting personalised FL into the population modeling paradigm where clients' models involve fixed common population parameters and random effects, aiming at explaining data heterogeneity. To derive convergence guarantees for our scheme, we introduce a new class of federated stochastic optimisation algorithms which relies on Markov chain Monte Carlo methods. Compared to existing personalised FL methods, the proposed methodology has important benefits: it is robust to client drift, practical for inference on new clients, and above all, enables uncertainty quantification under mild computational and memory overheads. We provide non-asymptotic convergence guarantees for the proposed algorithms and illustrate their performances on various personalised federated learning tasks.  ( 2 min )

We study constrained clustering, where constraints guide the clustering process. In existing works, two categories of constraints have been widely explored, namely pairwise and cardinality constraints. Pairwise constraints enforce the cluster labels of two instances to be the same (must-link constraints) or different (cannot-link constraints). Cardinality constraints encourage cluster sizes to satisfy a user-specified distribution. Most existing constrained clustering models can only utilize one category of constraints at a time. We enforce the above two categories into a unified clustering model starting with the integer program formulation of the standard K-means. As the two categories provide different useful information, utilizing both allow for better clustering performance. However, the optimization is difficult due to the binary and quadratic constraints in the unified formulation. To solve this, we utilize two techniques: equivalently replacing the binary constraints by the intersection of two continuous constraints; the other is transforming the quadratic constraints into bi-linear constraints by introducing extra variables. We derive an equivalent continuous reformulation with simple constraints, which can be efficiently solved by Alternating Direction Method of Multipliers. Extensive experiments on both synthetic and real data demonstrate when: (1) utilizing a single category of constraint, the proposed model is superior to or competitive with SOTA constrained clustering models, and (2) utilizing both categories of constraints jointly, the proposed model shows better performance than the case of the single category. The experiments show that the proposed method exploits the constraints to achieve perfect clustering performance with improved clustering to 2%-5% in classical clustering metrics, e.g. Adjusted Random, Mirkin's, and Huber's, indices outerperfomring other methods.  ( 2 min )

Calculation of Bayesian posteriors and model evidences typically requires numerical integration. Bayesian quadrature (BQ), a surrogate-model-based approach to numerical integration, is capable of superb sample efficiency, but its lack of parallelisation has hindered its practical applications. In this work, we propose a parallelised (batch) BQ method, employing techniques from kernel quadrature, that possesses an empirically exponential convergence rate. Additionally, just as with Nested Sampling, our method permits simultaneous inference of both posteriors and model evidence. Samples from our BQ surrogate model are re-selected to give a sparse set of samples, via a kernel recombination algorithm, requiring negligible additional time to increase the batch size. Empirically, we find that our approach significantly outperforms the sampling efficiency of both state-of-the-art BQ techniques and Nested Sampling in various real-world datasets, including lithium-ion battery analytics.  ( 2 min )

Lifelong learning aims to create AI systems that continuously and incrementally learn during a lifetime, similar to biological learning. Attempts so far have met problems, including catastrophic forgetting, interference among tasks, and the inability to exploit previous knowledge. While considerable research has focused on learning multiple input distributions, typically in classification, lifelong reinforcement learning (LRL) must also deal with variations in the state and transition distributions, and in the reward functions. Modulating masks, recently developed for classification, are particularly suitable to deal with such a large spectrum of task variations. In this paper, we adapted modulating masks to work with deep LRL, specifically PPO and IMPALA agents. The comparison with LRL baselines in both discrete and continuous RL tasks shows superior performance. We further investigated the use of a linear combination of previously learned masks to exploit previous knowledge when learning new tasks: not only is learning faster, the algorithm solves tasks that we could not otherwise solve from scratch due to extremely sparse rewards. The results suggest that RL with modulating masks is a promising approach to lifelong learning, to the composition of knowledge to learn increasingly complex tasks, and to knowledge reuse for efficient and faster learning.  ( 2 min )

We propose a continuous optimization framework for discovering a latent directed acyclic graph (DAG) from observational data. Our approach optimizes over the polytope of permutation vectors, the so-called Permutahedron, to learn a topological ordering. Edges can be optimized jointly, or learned conditional on the ordering via a non-differentiable subroutine. Compared to existing continuous optimization approaches our formulation has a number of advantages including: 1. validity: optimizes over exact DAGs as opposed to other relaxations optimizing approximate DAGs; 2. modularity: accommodates any edge-optimization procedure, edge structural parameterization, and optimization loss; 3. end-to-end: either alternately iterates between node-ordering and edge-optimization, or optimizes them jointly. We demonstrate, on real-world data problems in protein-signaling and transcriptional network discovery, that our approach lies on the Pareto frontier of two key metrics, the SID and SHD.  ( 2 min )

Machine learning (ML) models can underperform on certain population groups due to choices made during model development and bias inherent in the data. We categorize sources of discrimination in the ML pipeline into two classes: aleatoric discrimination, which is inherent in the data distribution, and epistemic discrimination, which is due to decisions during model development. We quantify aleatoric discrimination by determining the performance limits of a model under fairness constraints, assuming perfect knowledge of the data distribution. We demonstrate how to characterize aleatoric discrimination by applying Blackwell's results on comparing statistical experiments. We then quantify epistemic discrimination as the gap between a model's accuracy given fairness constraints and the limit posed by aleatoric discrimination. We apply this approach to benchmark existing interventions and investigate fairness risks in data with missing values. Our results indicate that state-of-the-art fairness interventions are effective at removing epistemic discrimination. However, when data has missing values, there is still significant room for improvement in handling aleatoric discrimination.  ( 2 min )

In the face of uncertainty, the need for probabilistic assessments has long been recognized in the literature on forecasting. In classification, however, comparative evaluation of classifiers often focuses on predictions specifying a single class through the use of simple accuracy measures, which disregard any probabilistic uncertainty quantification. I propose probabilistic top lists as a novel type of prediction in classification, which bridges the gap between single-class predictions and predictive distributions. The probabilistic top list functional is elicitable through the use of strictly consistent evaluation metrics. The proposed evaluation metrics are based on symmetric proper scoring rules and admit comparison of various types of predictions ranging from single-class point predictions to fully specified predictive distributions. The Brier score yields a metric that is particularly well suited for this kind of comparison.  ( 2 min )

It is believed that Gradient Descent (GD) induces an implicit bias towards good generalization in training machine learning models. This paper provides a fine-grained analysis of the dynamics of GD for the matrix sensing problem, whose goal is to recover a low-rank ground-truth matrix from near-isotropic linear measurements. It is shown that GD with small initialization behaves similarly to the greedy low-rank learning heuristics (Li et al., 2020) and follows an incremental learning procedure (Gissin et al., 2019): GD sequentially learns solutions with increasing ranks until it recovers the ground truth matrix. Compared to existing works which only analyze the first learning phase for rank-1 solutions, our result provides characterizations for the whole learning process. Moreover, besides the over-parameterized regime that many prior works focused on, our analysis of the incremental learning procedure also applies to the under-parameterized regime. Finally, we conduct numerical experiments to confirm our theoretical findings.  ( 2 min )

Recently, graph neural networks (GNNs) have shown success at learning representations of brain graphs derived from functional magnetic resonance imaging (fMRI) data. The majority of existing GNN methods, however, assume brain graphs are static over time and the graph adjacency matrix is known prior to model training. These assumptions are at odds with neuroscientific evidence that brain graphs are time-varying with a connectivity structure that depends on the choice of functional connectivity measure. Noisy brain graphs that do not truly represent the underling fMRI data can have a detrimental impact on the performance of GNNs. As a solution, we propose Dynamic Brain Graph Structure Learning (DBGSL), a novel method for learning the optimal time-varying dependency structure of fMRI data induced by a downstream prediction task. Experiments demonstrate DBGSL achieves state-of-the-art performance for sex classification using real-world resting-state and task fMRI data. Moreover, analysis of the learnt dynamic graphs highlights prediction-related brain regions which align with existing neuroscience literature.  ( 2 min )

Deep neural networks (DNNs) have proven to be highly effective in a variety of tasks, making them the go-to method for problems requiring high-level predictive power. Despite this success, the inner workings of DNNs are often not transparent, making them difficult to interpret or understand. This lack of interpretability has led to increased research on inherently interpretable neural networks in recent years. Models such as Neural Additive Models (NAMs) achieve visual interpretability through the combination of classical statistical methods with DNNs. However, these approaches only concentrate on mean response predictions, leaving out other properties of the response distribution of the underlying data. We propose Neural Additive Models for Location Scale and Shape (NAMLSS), a modelling framework that combines the predictive power of classical deep learning models with the inherent advantages of distributional regression while maintaining the interpretability of additive models.  ( 2 min )

We present Myriad, a testbed written in JAX for learning and planning in real-world continuous environments. The primary contributions of Myriad are threefold. First, Myriad provides machine learning practitioners access to trajectory optimization techniques for application within a typical automatic differentiation workflow. Second, Myriad presents many real-world optimal control problems, ranging from biology to medicine to engineering, for use by the machine learning community. Formulated in continuous space and time, these environments retain some of the complexity of real-world systems often abstracted away by standard benchmarks. As such, Myriad strives to serve as a stepping stone towards application of modern machine learning techniques for impactful real-world tasks. Finally, we use the Myriad repository to showcase a novel approach for learning and control tasks. Trained in a fully end-to-end fashion, our model leverages an implicit planning module over neural ordinary differential equations, enabling simultaneous learning and planning with complex environment dynamics.  ( 2 min )

How best to incorporate historical data to "warm start" bandit algorithms is an open question: naively initializing reward estimates using all historical samples can suffer from spurious data and imbalanced data coverage, leading to computational and storage issues $\unicode{x2014}$ particularly salient in continuous action spaces. We propose Artificial Replay, a meta-algorithm for incorporating historical data into any arbitrary base bandit algorithm. Artificial Replay uses only a fraction of the historical data compared to a full warm-start approach, while still achieving identical regret for base algorithms that satisfy independence of irrelevant data (IIData), a novel and broadly applicable property that we introduce. We complement these theoretical results with experiments on $K$-armed and continuous combinatorial bandit algorithms, including a green security domain using real poaching data. We show the practical benefits of Artificial Replay, including for base algorithms that do not satisfy IIData.  ( 2 min )

We study the error of linear regression in the face of adversarial attacks. In this framework, an adversary changes the input to the regression model in order to maximize the prediction error. We provide bounds on the prediction error in the presence of an adversary as a function of the parameter norm and the error in the absence of such an adversary. We show how these bounds make it possible to study the adversarial error using analysis from non-adversarial setups. The obtained results shed light on the robustness of overparameterized linear models to adversarial attacks. Adding features might be either a source of additional robustness or brittleness. On the one hand, we use asymptotic results to illustrate how double-descent curves can be obtained for the adversarial error. On the other hand, we derive conditions under which the adversarial error can grow to infinity as more features are added, while at the same time, the test error goes to zero. We show this behavior is caused by the fact that the norm of the parameter vector grows with the number of features. It is also established that $\ell_\infty$ and $\ell_2$-adversarial attacks might behave fundamentally differently due to how the $\ell_1$ and $\ell_2$-norms of random projections concentrate. We also show how our reformulation allows for solving adversarial training as a convex optimization problem. This fact is then exploited to establish similarities between adversarial training and parameter-shrinking methods and to study how the training might affect the robustness of the estimated models.  ( 2 min )

In real-world data labeling applications, annotators often provide imperfect labels. It is thus common to employ multiple annotators to label data with some overlap between their examples. We study active learning in such settings, aiming to train an accurate classifier by collecting a dataset with the fewest total annotations. Here we propose ActiveLab, a practical method to decide what to label next that works with any classifier model and can be used in pool-based batch active learning with one or multiple annotators. ActiveLab automatically estimates when it is more informative to re-label examples vs. labeling entirely new ones. This is a key aspect of producing high quality labels and trained models within a limited annotation budget. In experiments on image and tabular data, ActiveLab reliably trains more accurate classifiers with far fewer annotations than a wide variety of popular active learning methods.  ( 2 min )

We study deviation of U-statistics when samples have heavy-tailed distribution so the kernel of the U-statistic does not have bounded exponential moments at any positive point. We obtain an exponential upper bound for the tail of the U-statistics which clearly denotes two regions of tail decay, the first is a Gaussian decay and the second behaves like the tail of the kernel. For several common U-statistics, we also show the upper bound has the right rate of decay as well as sharp constants by obtaining rough logarithmic limits which in turn can be used to develop LDP for U-statistics. In spite of usual LDP results in the literature, processes we consider in this work have LDP speed slower than their sample size $n$.  ( 2 min )

Self-Supervised Learning (SSL) methods operate on unlabeled data to learn robust representations useful for downstream tasks. Most SSL methods rely on augmentations obtained by transforming the 2D image pixel map. These augmentations ignore the fact that biological vision takes place in an immersive three-dimensional, temporally contiguous environment, and that low-level biological vision relies heavily on depth cues. Using a signal provided by a pretrained state-of-the-art monocular RGB-to-depth model (the \emph{Depth Prediction Transformer}, Ranftl et al., 2021), we explore two distinct approaches to incorporating depth signals into the SSL framework. First, we evaluate contrastive learning using an RGB+depth input representation. Second, we use the depth signal to generate novel views from slightly different camera positions, thereby producing a 3D augmentation for contrastive learning. We evaluate these two approaches on three different SSL methods -- BYOL, SimSiam, and SwAV -- using ImageNette (10 class subset of ImageNet), ImageNet-100 and ImageNet-1k datasets. We find that both approaches to incorporating depth signals improve the robustness and generalization of the baseline SSL methods, though the first approach (with depth-channel concatenation) is superior. For instance, BYOL with the additional depth channel leads to an increase in downstream classification accuracy from 85.3\% to 88.0\% on ImageNette and 84.1\% to 87.0\% on ImageNet-C.  ( 2 min )

In fair classification, it is common to train a model, and to compare and correct subgroup-specific error rates for disparities. However, even if a model's classification decisions satisfy a fairness metric, it is not necessarily the case that these decisions are equally confident. This becomes clear if we measure variance: We can fix everything in the learning process except the subset of training data, train multiple models, measure (dis)agreement in predictions for each test example, and interpret disagreement to mean that the learning process is more unstable with respect to its classification decision. Empirically, some decisions can in fact be so unstable that they are effectively arbitrary. To reduce this arbitrariness, we formalize a notion of self-consistency of a learning process, develop an ensembling algorithm that provably increases self-consistency, and empirically demonstrate its utility to often improve both fairness and accuracy. Further, our evaluation reveals a startling observation: Applying ensembling to common fair classification benchmarks can significantly reduce subgroup error rate disparities, without employing common pre-, in-, or post-processing fairness interventions. Taken together, our results indicate that variance, particularly on small datasets, can muddle the reliability of conclusions about fairness. One solution is to develop larger benchmark tasks. To this end, we release a toolkit that makes the Home Mortgage Disclosure Act datasets easily usable for future research.  ( 2 min )

We study the causal bandit problem when the causal graph is unknown and develop an efficient algorithm for finding the parent node of the reward node using atomic interventions. We derive the exact equation for the expected number of interventions performed by the algorithm and show that under certain graphical conditions it could perform either logarithmically fast or, under more general assumptions, slower but still sublinearly in the number of variables. We formally show that our algorithm is optimal as it meets the universal lower bound we establish for any algorithm that performs atomic interventions. Finally, we extend our algorithm to the case when the reward node has multiple parents. Using this algorithm together with a standard algorithm from bandit literature leads to improved regret bounds.  ( 2 min )

Recently, flat-minima optimizers, which seek to find parameters in low-loss neighborhoods, have been shown to improve a neural network's generalization performance over stochastic and adaptive gradient-based optimizers. Two methods have received significant attention due to their scalability: 1. Stochastic Weight Averaging (SWA), and 2. Sharpness-Aware Minimization (SAM). However, there has been limited investigation into their properties and no systematic benchmarking of them across different domains. We fill this gap here by comparing the loss surfaces of the models trained with each method and through broad benchmarking across computer vision, natural language processing, and graph representation learning tasks. We discover several surprising findings from these results, which we hope will help researchers further improve deep learning optimizers, and practitioners identify the right optimizer for their problem.  ( 2 min )

The completeness axiom renders the explanation of a post-hoc XAI method only locally faithful to the model, i.e. for a single decision. For the trustworthy application of XAI, in particular for high-stake decisions, a more global model understanding is required. Recently, concept-based methods have been proposed, which are however not guaranteed to be bound to the actual model reasoning. To circumvent this problem, we propose Multi-dimensional Concept Discovery (MCD) as an extension of previous approaches that fulfills a completeness relation on the level of concepts. Our method starts from general linear subspaces as concepts and does neither require reinforcing concept interpretability nor re-training of model parts. We propose sparse subspace clustering to discover improved concepts and fully leverage the potential of multi-dimensional subspaces. MCD offers two complementary analysis tools for concepts in input space: (1) concept activation maps, that show where a concept is expressed within a sample, allowing for concept characterization through prototypical samples, and (2) concept relevance heatmaps, that decompose the model decision into concept contributions. Both tools together enable a detailed understanding of the model reasoning, which is guaranteed to relate to the model via a completeness relation. This paves the way towards more trustworthy concept-based XAI. We empirically demonstrate the superiority of MCD against more constrained concept definitions.  ( 2 min )

Convolutional neural networks (CNN) have been successful in machine learning applications. Their success relies on their ability to consider space invariant local features. We consider the use of CNN to fit nuisance models in semiparametric estimation of the average causal effect of a treatment. In this setting, nuisance models are functions of pre-treatment covariates that need to be controlled for. In an application where we want to estimate the effect of early retirement on a health outcome, we propose to use CNN to control for time-structured covariates. Thus, CNN is used when fitting nuisance models explaining the treatment and the outcome. These fits are then combined into an augmented inverse probability weighting estimator yielding efficient and uniformly valid inference. Theoretically, we contribute by providing rates of convergence for CNN equipped with the rectified linear unit activation function and compare it to an existing result for feedforward neural networks. We also show when those rates guarantee uniformly valid inference. A Monte Carlo study is provided where the performance of the proposed estimator is evaluated and compared with other strategies. Finally, we give results on a study of the effect of early retirement on hospitalization using data covering the whole Swedish population.  ( 2 min )

Creating fast and accurate force fields is a long-standing challenge in computational chemistry and materials science. Recently, several equivariant message passing neural networks (MPNNs) have been shown to outperform models built using other approaches in terms of accuracy. However, most MPNNs suffer from high computational cost and poor scalability. We propose that these limitations arise because MPNNs only pass two-body messages leading to a direct relationship between the number of layers and the expressivity of the network. In this work, we introduce MACE, a new equivariant MPNN model that uses higher body order messages. In particular, we show that using four-body messages reduces the required number of message passing iterations to just two, resulting in a fast and highly parallelizable model, reaching or exceeding state-of-the-art accuracy on the rMD17, 3BPA, and AcAc benchmark tasks. We also demonstrate that using higher order messages leads to an improved steepness of the learning curves.  ( 2 min )

In this study, we address the problem of optimizing multi-output black-box functions under uncertain environments. We formulate this problem as the estimation of the uncertain Pareto-frontier (PF) of a multi-output Bayesian surrogate model with two types of variables: design variables and environmental variables. We consider this problem within the context of Bayesian optimization (BO) under uncertain environments, where the design variables are controllable, whereas the environmental variables are assumed to be random and not controllable. The challenge of this problem is to robustly estimate the PF when the distribution of the environmental variables is unknown, that is, to estimate the PF when the environmental variables are generated from the worst possible distribution. We propose a method for solving the BO problem by appropriately incorporating the uncertainties of the environmental variables and their probability distribution. We demonstrate that the proposed method can find an arbitrarily accurate PF with high probability in a finite number of iterations. We also evaluate the performance of the proposed method through numerical experiments.  ( 2 min )

Likelihood-free inference involves inferring parameter values given observed data and a simulator model. The simulator is computer code which takes parameters, performs stochastic calculations, and outputs simulated data. In this work, we view the simulator as a function whose inputs are (1) the parameters and (2) a vector of pseudo-random draws. We attempt to infer all these inputs conditional on the observations. This is challenging as the resulting posterior can be high dimensional and involve strong dependence. We approximate the posterior using normalizing flows, a flexible parametric family of densities. Training data is generated by likelihood-free importance sampling with a large bandwidth value epsilon, which makes the target similar to the prior. The training data is "distilled" by using it to train an updated normalizing flow. The process is iterated, using the updated flow as the importance sampling proposal, and slowly reducing epsilon so the target becomes closer to the posterior. Unlike most other likelihood-free methods, we avoid the need to reduce data to low dimensional summary statistics, and hence can achieve more accurate results. We illustrate our method in two challenging examples, on queuing and epidemiology.  ( 2 min )

We consider the community recovery problem on a multilayer variant of the hypergraph stochastic block model (HSBM). Each layer is associated with an independent realization of a d-uniform HSBM on N vertices. Given the aggregated number of hyperedges incident to each pair of vertices, represented using a similarity matrix, the goal is to obtain a partition of the N vertices into disjoint communities. In this work, we investigate a semidefinite programming (SDP) approach and obtain information-theoretic conditions on the model parameters that guarantee exact recovery both in the assortative and the disassortative cases.  ( 2 min )

The main goal of machine learning (ML) is to study and improve mathematical models which can be trained with data provided by the environment to infer the future and to make decisions without necessarily having complete knowledge of all influencing elements. In this work, we describe how ML can be a powerful tool in studying climate modeling. Tree ring growth was used as an implementation in different aspects, for example, studying the history of buildings and environment. By growing and via the time, a new layer of wood to beneath its bark by the tree. After years of growing, time series can be applied via a sequence of tree ring widths. The purpose of this paper is to use ML algorithms and Extreme Value Theory in order to analyse a set of tree ring widths data from nine trees growing in Nottinghamshire. Initially, we start by exploring the data through a variety of descriptive statistical approaches. Transforming data is important at this stage to find out any problem in modelling algorithm. We then use algorithm tuning and ensemble methods to improve the k-nearest neighbors (KNN) algorithm. A comparison between the developed method in this study ad other methods are applied. Also, extreme value of the dataset will be more investigated. The results of the analysis study show that the ML algorithms in the Random Forest method would give accurate results in the analysis of tree ring widths data from nine trees growing in Nottinghamshire with the lowest Root Mean Square Error value. Also, we notice that as the assumed ARMA model parameters increased, the probability of selecting the true model also increased. In terms of the Extreme Value Theory, the Weibull distribution would be a good choice to model tree ring data.  ( 2 min )

Loss functions serve as the foundation of supervised learning and are often chosen prior to model development. To avoid potentially ad hoc choices of losses, statistical decision theory describes a desirable property for losses known as \emph{properness}, which asserts that Bayes' rule is optimal. Recent works have sought to \emph{learn losses} and models jointly. Existing methods do this by fitting an inverse canonical link function which monotonically maps $\mathbb{R}$ to $[0,1]$ to estimate probabilities for binary problems. In this paper, we extend monotonicity to maps between $\mathbb{R}^{C-1}$ and the projected probability simplex $\tilde{\Delta}^{C-1}$ by using monotonicity of gradients of convex functions. We present {\sc LegendreTron} as a novel and practical method that jointly learns \emph{proper canonical losses} and probabilities for multiclass problems. Tested on a benchmark of domains with up to 1,000 classes, our experimental results show that our method consistently outperforms the natural multiclass baseline under a $t$-test at 99% significance on all datasets with greater than 10 classes.  ( 2 min )

Normalizing flows (NF) are a class of powerful generative models that have gained popularity in recent years due to their ability to model complex distributions with high flexibility and expressiveness. In this work, we introduce a new type of normalizing flow that is tailored for modeling positions and orientations of multiple objects in three-dimensional space, such as molecules in a crystal. Our approach is based on two key ideas: first, we define smooth and expressive flows on the group of unit quaternions, which allows us to capture the continuous rotational motion of rigid bodies; second, we use the double cover property of unit quaternions to define a proper density on the rotation group. This ensures that our model can be trained using standard likelihood-based methods or variational inference with respect to a thermodynamic target density. We evaluate the method by training Boltzmann generators for two molecular examples, namely the multi-modal density of a tetrahedral system in an external field and the ice XI phase in the TIP4P-Ew water model. Our flows can be combined with flows operating on the internal degrees of freedom of molecules, and constitute an important step towards the modeling of distributions of many interacting molecules.  ( 2 min )

Likelihood-free inference methods typically make use of a distance between simulated and real data. A common example is the maximum mean discrepancy (MMD), which has previously been used for approximate Bayesian computation, minimum distance estimation, generalised Bayesian inference, and within the nonparametric learning framework. The MMD is commonly estimated at a root-$m$ rate, where $m$ is the number of simulated samples. This can lead to significant computational challenges since a large $m$ is required to obtain an accurate estimate, which is crucial for parameter estimation. In this paper, we propose a novel estimator for the MMD with significantly improved sample complexity. The estimator is particularly well suited for computationally expensive smooth simulators with low- to mid-dimensional inputs. This claim is supported through both theoretical results and an extensive simulation study on benchmark simulators.  ( 2 min )

We study how training molds the Riemannian geometry induced by neural network feature maps. At infinite width, neural networks with random parameters induce highly symmetric metrics on input space. Feature learning in networks trained to perform classification tasks magnifies local areas along decision boundaries. These changes are consistent with previously proposed geometric approaches for hand-tuning of kernel methods to improve generalization.  ( 2 min )

Graphs are a natural representation of brain activity derived from functional magnetic imaging (fMRI) data. It is well known that clusters of anatomical brain regions, known as functional connectivity networks (FCNs), encode temporal relationships which can serve as useful biomarkers for understanding brain function and dysfunction. Previous works, however, ignore the temporal dynamics of the brain and focus on static graphs. In this paper, we propose a dynamic brain graph deep generative model (DBGDGM) which simultaneously clusters brain regions into temporally evolving communities and learns dynamic unsupervised node embeddings. Specifically, DBGDGM represents brain graph nodes as embeddings sampled from a distribution over communities that evolve over time. We parameterise this community distribution using neural networks that learn from subject and node embeddings as well as past community assignments. Experiments demonstrate DBGDGM outperforms baselines in graph generation, dynamic link prediction, and is comparable for graph classification. Finally, an analysis of the learnt community distributions reveals overlap with known FCNs reported in neuroscience literature.  ( 2 min )

Over the past few decades, a number of methods have been proposed for causal effect estimation, yet few have been demonstrated to be effective in handling data with complex structures, such as images. To fill this gap, we propose a Causal Multi-task Deep Ensemble (CMDE) framework to learn both shared and group-specific information from the study population and prove its equivalence to a multi-task Gaussian process (GP) with coregionalization kernel a priori. Compared to multi-task GP, CMDE efficiently handles high-dimensional and multi-modal covariates and provides pointwise uncertainty estimates of causal effects. We evaluate our method across various types of datasets and tasks and find that CMDE outperforms state-of-the-art methods on a majority of these tasks.  ( 2 min )

Under losses which are potentially heavy-tailed, we consider the task of minimizing sums of the loss mean and standard deviation, without trying to accurately estimate the variance. By modifying a technique for variance-free robust mean estimation to fit our problem setting, we derive a simple learning procedure which can be easily combined with standard gradient-based solvers to be used in traditional machine learning workflows. Empirically, we verify that our proposed approach, despite its simplicity, performs as well or better than even the best-performing candidates derived from alternative criteria such as CVaR or DRO risks on a variety of datasets.  ( 2 min )

For some context, I plan on eventually majoring in neuroscience. I am enrolling in a local state college soon. I want to get my associates out of the way, and then transferring to a college with a good neuroscience program. It seems like neural networks, are an exciting avenue for research. There's a lot more neuroscience related research being published using neural networks. What courses would you guys recommend me enrolling in? I feel like the obvious one is software development, but maybe there are some others as well. I'd appreciate any insight, thanks! submitted by /u/daddydilly694-20 [link] [comments]  ( 41 min )

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Hey All! I wrote this story and would appreciate your support on my channel and reviews. You can also give me stories for the channel. Thank You for your time :) https://youtu.be/-aM7cSbFFFY The sky was a deep shade of black as the group of friends made their way to the cabin, the only light coming from the beams of their headlights piercing through the heavy rain. The cabin, located deep in the woods, was said to be haunted, but the friends brushed off the rumors as nothing more than tales meant to scare. As they settled in for the night, they laughed and joked, telling ghost stories and watching horror movies. They passed jokes about how they would run if they saw a ghost, unaware of the danger lurking outside. But their laughter was cut short when Dave stumbled across a letter in the…  ( 46 min )

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I'v been thinking a lot about Marshall McLuhan and his 4 laws of media. Specifically, the one that states that all new forms of media cause something to be retrieved from the past. What will ChatGPT and AI revive and retrieve? I put some more thoughts in my blog. Would love to hear your thoughts on it. https://bobhutchins.substack.com/p/what-media-format-will-chatgpt-and submitted by /u/Interesting_Status64 [link] [comments]  ( 41 min )

I'm putting together a trivia night, and one idea I have for a round is "The Pen*s Game" where I replace a word from a famous movie quote with the word "pen*s". I could simply replace it with my own voice, but I don't think it would sound as good/be as funny, so I think it would be amazing to instead use a tool (presumably AI-powered) to achieve this. Is there a reasonably user-friendly way of doing this?Ideally it would be some magical tool that has a nice GUI and celebrity voices already trained, though I doubt this exists... I am well-versed in Python, and am always looking to learn new tools, but I don't have the time to scrape voice data for each actor and train a model (not that I even know where I'd start on that front). As an example, imagine this clip from Shrek except "parfait" is replaced with "pen*s". https://youtu.be/-FtCTW2rVFM?t=86 I don't know this threads rules, so I censor "pen*s" just in case. Any suggestions would be appreciated! Thank you. submitted by /u/wendeborn8 [link] [comments]  ( 41 min )

Hi everyone ! I had this weird idea lately, with the rise of AI to the mainstream, to implement some kind of "Simulator", where one could input a webcam picture, some basic info through a form, & get an alternate small narrated video narrated of one's future. I'm looking for suggestions for open source AI APIs I could use for it. My idea, very simplistically put, is to combine them through input, outputs and some basic logic manipulation. I'm also looking for recommendations for the stack I could use. I've worked with NodeJS and Java w/ Spring Boot on backend, & Angular for frontend. Any recommendations based in the APIs? submitted by /u/WhereIsBryan [link] [comments]  ( 41 min )

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Hi. I tried to voice chat with Kuki on Telegram but she still doesn't have this ability. Replika has voice calls. Do you know other AI apps that can already speak using voice? submitted by /u/Trainer_Red99 [link] [comments]  ( 40 min )

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1D: MusicLM, VALL-E 2D: Stable Diffusion, DALL-E, MidJourney 3D (or 2+1D): Imagen-video, Phenaki 3D: Magic3D, DreamFusion, Point-E 4D (or 3+1D): Make-A-Video-3D [Searchcolab] What’s next? 🤔 https://reddit.com/link/10p6vw9/video/gqbnrsaxh7fa1/player submitted by /u/Maleficent_Suit1591 [link] [comments]  ( 41 min )

Similar to chatgpt, etc. but it doesn't have all the knowledge, but just from a very special field. E.g. if you would like to create an AI for kids, you feed 1000 kids books into it, and it would respond exclusively in a child-friendly or goofy way. It's simply not possible that it responds in any other way, because it doesn't know about the rest of the world. submitted by /u/EndlessSenseless [link] [comments]  ( 41 min )

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https://ainewsbase.com/google-musiclm-copyright-issues-not-releasing/ The samples they do show might just sound weird because of the stored file or whatever but the sound definitely sounds kinda weird. submitted by /u/SPEEDYFISHY2000 [link] [comments]  ( 40 min )

I spend about 5 hours a day reading about AI and the news is a lot to keep up with - however there's a lot of big picture AI information that is a good foundation for understanding the future implications of AI. I think these three books offer a good variety of perspective from the philosophical, business, and strategy side of AI. Philosophy: Superintelligence by Nick Bostrom - This S-tier book explores the potential risks and benefits of creating artificial intelligence beyond human levels. The book argues that if the development of superintelligence proceeds rapidly, it could pose an existential threat to humanity. Bostrom paints an incredibly articulate perspective on why we must consider the possibility of creating AI in a way that aligns with human values, and that we must prepare …  ( 44 min )

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I suggest the need for a new subreddit, where people can announce their creations. You know: "I've created an AI to make s'mores..." "I've created an AI to sort my comic books..." "I've created an AI to find me a girlfriend..." ...ad nauseum. submitted by /u/PredictorX1 [link] [comments]  ( 40 min )

Hello guys, Have you found any application of AI in the construction industry (notwithstanding the design/modelization)? I've been following the industry for ages and I believe there is so much to be done particularly with AI as it can manage dependancies.. I've quite a few ideas too; get in touch if you are interested to discuss over this :) submitted by /u/MexsEU [link] [comments]  ( 41 min )

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Doing a survey of object detection papers with plausible application to pose-estimation tasks. Came across the paper "You Only Learn One Representation" and, while the theory seems interesting, I want to hear people's opinions before doing a deep dive into the theory. submitted by /u/answersareallyouneed [link] [comments]  ( 42 min )

https://peltarion.com/blog/data-science/towards-a-token-free-future-in-nlp submitted by /u/EducationalCicada [link] [comments]  ( 42 min )

I’m an ML Engineer at Hive AI and I’ve been working on a ChatGPT Detector. Here is a free demo we have up: https://hivemoderation.com/ai-generated-content-detection From our benchmarks it’s significantly better than similar solutions like GPTZero and OpenAI’s GPT2 Output Detector. On our internal datasets, we’re seeing balanced accuracies of >99% for our own model compared to around 60% for GPTZero and 84% for OpenAI’s GPT2 Detector. Feel free to try it out and let us know if you have any feedback! submitted by /u/qthai912 [link] [comments]  ( 56 min )

In order to improve my talking skills, I am doing a little series on how to setup Stable Diffusion on Paperspace, and I am astounded how much time it takes to do the audio editing. Well, part of the reason is that I've only been doing this for 3 days and my process is very inefficient, but it feels that in the current time, neural nets should be able to do things like remove uhms, lip smacking and breath intakes. I've looked around, and this post from 9 years ago says the only choice is to edit it by hand. Is that still true? submitted by /u/abstractcontrol [link] [comments]  ( 43 min )

I've been working in the speech and voice space for a while now and am now building out some tooling in the space to make it easier for researchers/engineers/developers to build speech processing systems and features; I'd love to hear what people in ML struggle with when you're trying to build or work with speech processing for your projects/products (beyond speech-to-text APIs) submitted by /u/jiamengial [link] [comments]  ( 47 min )

I am a researcher at a US university and have a budget of 25k to build a PC for training various ML algorithms (e.g. DRL, neuromorphic computing, VAE, etc). I'm trying to decide between going for prebuilds (like https://lambdalabs.com/gpu-workstations/vector) or building with consumer cards like 4090s. Any advice on which is the most bang for the price? Im not sure how much Im giving up by going for consumer 24g cards vs a6000, 6000 ada but prebuild prices go up quick. Warrantee vs building it myself isn't an issue submitted by /u/seanrescs [link] [comments]  ( 44 min )

Paper: https://arxiv.org/abs/2212.10561 Github: https://github.com/ezelikman/parsel Twitter: https://twitter.com/ericzelikman/status/1618426056163356675?s=20 Website: https://zelikman.me/parselpaper/ Code Generation on APPS Leaderboard: https://paperswithcode.com/sota/code-generation-on-apps Abstract: Despite recent success in large language model (LLM) reasoning, LLMs struggle with hierarchical multi-step reasoning tasks like generating complex programs. For these tasks, humans often start with a high-level algorithmic design and implement each part gradually. We introduce Parsel, a framework enabling automatic implementation and validation of complex algorithms with code LLMs, taking hierarchical function descriptions in natural language as input. We show that Parsel can be …  ( 45 min )

Hi guys. It's been some time since I started developing my Keras models, but now is the first time I am trying to push it to production. My Keras model looks like this: model = Sequential() model.add(Bidirectional(LSTM(256, return_sequences=True))) model.add(Bidirectional(LSTM(256, return_sequences=True))) model.add(TimeDistributed(Dense(1, activation='sigmoid'))) model.compile(loss='binary_crossentropy', optimizer='adam', metrics=['accuracy']) My problem is I need to run through about 25 of these for every written sentence. There is going to be an online editor, where users can paste text for my analysis. That means up to about 300 words or about 20 sentences at once. With the current time to run each network (about 0.2s), that means 25 * 0,2 * 20 or about 100s per user input. I am going for 30 seconds at most with potentially dozens of users at once. Ideally on a Raspberry Pi 4. The internet is surely gonna back me up I thought to myself and started googling. If only I know what kind of a rabbit hole I was about to fall into. First I converted my Keras model into a TensorFlow frozen graph model. 10x time improvement on CPU, but still at 0.2s on average. Another thing I think may boost the performance is retraining the models for variable input shape (currently I always feed in 50 values). With the average sentence size of 16 words this may, from what I understand, lead to a 3 times boost? My question is: now what? What can I do to make it faster? Is it even possible to run it on a Raspberry Pi 4 and get reasonable response times? If not, what is my best option on a tight budget? submitted by /u/ProfessionalOverall8 [link] [comments]  ( 45 min )

From the given link!, I gather that it is a large-scale Transformer trained to use digital tools like a web browser. Right now, it’s hooked up to a Chrome extension which allows it to observe what’s happening in the browser and take certain actions, like clicking, typing, and scrolling, etc. I am interested in knowing the broad steps involved in building something like this. submitted by /u/smred123 [link] [comments]  ( 43 min )

The general consensus seems to be that large language models, and ChatGPT in particular, have a problem with accuracy and hallucination. As compared to what, is often unclear, but let's say as compared to other NLP methods of question answering, language understanding or as compared to Google Search. I haven't really been able to find any reliable sources documenting this accuracy problem, though. The SuperGLUE benchmark has GPT-3 ranked #24, not terrible, but outperformed by old models like T5, which seems odd. GLUE nothing. SQUAD nothing. So, I'm curious: Is there any benchmark or metric reflecting the seeming step-function made by ChatGPT that's got everyone so excited? I definitely feel like there's a difference between gpt-3 and chatGPT, but is it measurable or is it just vibes? Is there any metric showing ChatGPT's problem with fact hallucination and accuracy? Am I off the mark here looking at question-answering benchmarks as an assessment of LLMs? Thanks submitted by /u/mettle [link] [comments]  ( 46 min )

Has anyone come across studies on GPT3 text-davinci-003's zero/few-shot performance over various NLP benchmarks and how they compare to current SoTA? E.g GLUE, SuperGLUE and over more classic ones like CoNLL 2003 NER. I thought it would be pretty interesting to see how far zero/few-shot learning with LLM has progressed with RLHF and instruction tuning. Am surprised that nobody has done such a benchmark yet. submitted by /u/gamerx88 [link] [comments]  ( 42 min )

Hi all! Given X ∈ ℝ Nx, Y ∈ ℝ Ny, β ∈ ℝ+, so W = YXT(XXT+βI)-1 (with the Moore–Penrose pseudoinverse) where A = YXT and B = XXT+βI. If we consider an arbitrary number of indices/units < Nx, and so we consider only some columns of matrix A and some columns and rows (crosses) of B. The rest of A and B are zeros. The approach above of sparsify A and B will break the ridge regression solution when W=AB-1? If yes, there are ways to avoid it? Many thanks! submitted by /u/antodima [link] [comments]  ( 43 min )

I'm looking for help/feedback with this paper. Please let me know if the method is interesting and if there's ways to improve it! https://arxiv.org/abs/2301.10115 Abstract: Gradient boosted decision trees are some of the most popular algorithms in applied machine learning. They are a flexible and powerful tool that can robustly fit to any tabular dataset in a scalable and computationally efficient way. One of the most critical parameters to tune when fitting these models are the various penalty terms used to distinguish signal from noise in the current model. These penalties are effective in practice, but are lacking in robust theoretical justifications. In this paper we develop and present a novel theoretically justified hypothesis test of split quality for gradient boosted tree ensembles and demonstrate that using this method instead of the common penalty terms leads to a significant reduction in out of sample loss. Additionally, this method provides a theoretically well-justified stopping condition for the tree growing algorithm. We also present several innovative extensions to the method, opening the door for a wide variety of novel tree pruning algorithms. submitted by /u/asi_dm [link] [comments]  ( 43 min )

https://github.com/tysam-code/hlb-CIFAR10 submitted by /u/tysam_and_co [link] [comments]  ( 53 min )

The global mobile app development revenue is $526 billion, making it one of the most flourishing industries worldwide. Android controls 73% of the market share. So, if you have plans to build an Android app, there’s no better time. However, to ensure your Android app stands out, you must keep an eye on the latest… Read More »Top Android App Development Trends in 2023 The post Top Android App Development Trends in 2023 appeared first on Data Science Central.  ( 22 min )

During the 1970s, Ethernet pioneer and 3Com Internet equipment company founder Bob Metcalfe was working on something called the “Data Reconfiguration Service” for the early Internet. “It was an effort to write a special purpose programming language to convert data formats, Metcalfe said during a 2021 OriginTrail.io panel session. “And the goal was so that… Read More »Enabling contextual computing in today’s enterprise information fabrics The post Enabling contextual computing in today’s enterprise information fabrics appeared first on Data Science Central.  ( 21 min )

Amazon SageMaker provides a suite of built-in algorithms, pre-trained models, and pre-built solution templates to help data scientists and machine learning (ML) practitioners get started on training and deploying ML models quickly. You can use these algorithms and models for both supervised and unsupervised learning. They can process various types of input data, including tabular, […]  ( 12 min )

Amazon Forecast is a fully managed service that uses machine learning (ML) to generate highly accurate forecasts, without requiring any prior ML experience. Forecast is applicable in a wide variety of use cases, including estimating supply and demand for inventory management, travel demand forecasting, workforce planning, and computing cloud infrastructure usage. You can use Forecast […]  ( 10 min )

I’m not sure whether automatic text completion on a mobile device is a net good. It sometimes saves a few taps, but it seems like it’s at least as likely to cause extra work. Although I’m ambivalent about autocomplete on my phone, I like it in my text editor. The difference is that in my […] Good autocomplete first appeared on John D. Cook.  ( 6 min )

Does anyone know which library has the best support for recurrent RL algorithms? It seems like many implement recurrent PPO and maybe one other recurrent algorithm and that's it. Most implementations treat recurrence as an afterthought, making it buggy and hard to extend. I'd like a library with first-class recurrent support for: DQN/Rainbow SAC PPO etc. Is anyone familiar with such a library? submitted by /u/smorad [link] [comments]  ( 42 min )

Gen-Meta is a learning-to-learn method for evolutionary illumination that is competitive against SotA methods in Nevergrad, with a much superior scalability for large-scale optimization. The key to out-of-sample robustness in portfolio optimization is quality-diversity optimization, where one aims to obtain multiple diverse solutions of high quality, rather than one. Generative meta-learning is the only portfolio optimization method that performs QD optimization to obtain a robust ensemble portfolio consisting of several de-correlated sub-portfolios. In the below image, the red line is the index to be tracked, and the blue line is the sparse portfolio ensembled from a thousand behaviorally-diverse sub-portfolios co-optimized (other lines). ​ Red Line: Tracked Index, Blue Line: Sparse Ensemble, Others: Diverse Subportfolios In Gen-Meta portfolio optimization, a Monte-Carlo optimization is performed over those portfolio candidates to reward each individual separately in randomly selected historical periods. To further optimize the portfolio robustness, the portfolio weights of the candidates are heavily corrupted first by adding noise and then dropping out the vast majority of their weights. I previously open-sourced the application of Gen-Meta in sparse index-tracking. Hence, I invite you to do your ablation study to see how each technique affects the out-of-sample robustness. The following repository includes comments on those critical techniques performed to obtain a robust ensemble from behaviorally-diverse high-quality portfolios co-optimized with Gen-Meta. The codes for Gen-Meta in sparse index-tracking The comparison in-between Gen-Meta & Nevergrad submitted by /u/k_yuksel [link] [comments]  ( 42 min )

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Things the video covers: What is intelligence? What is A.I.? What is the best currently available and what are the benefits? How does it work? What are the downsides? The increasing speed of human technological advancement Why A.I. actually terrifies me! (Some scenarios) I hope you enjoy it! submitted by /u/casualbob_uk [link] [comments]  ( 41 min )

Farmers still exist today but they exist in drastically fewer numbers than two centuries ago. The modern farming machinery and techniques did not replace farmers but made the industry much less labor intensive. Nowadays programming is a labor intensive activity with relative high salaries. AI is introducing the possibility to do this activity, that worldwide cost companies billions of dollars in programmers salaries, much more efficiently. In my opinion, this is the goal of companies like OpenAI. They know that they can’t remove humans out of the loop because current AI is not able to substitute all human cognitive capabilities that intervine in a software developer daily job; like talking with the client, figuring out what he wants and translating it to functional requirements. But nonetheless, they think they have a clear shot to make programming a non labor intensive activity like farming is today. Of course, this is a compelling multibillion business opportunity that is attracting increasing capital from the tech and the financial sectors. submitted by /u/masterile [link] [comments]  ( 43 min )

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https://youtu.be/Y6gXZ61NnOE submitted by /u/sigmabruuh [link] [comments]  ( 42 min )

I'm trying to see if I can use an image generator to illustrate a story I am writing. The thing is the story itself is action-packed and dramatic so I thought I could illustrate it instead as a graphic novel generated by AI but I am worried about the consistency an quality of the images. Also, I can't really use passages in the story as a prompt because the generators don't seem to illustrate the scene well. Any suggestions? submitted by /u/swagonflyyyy [link] [comments]  ( 41 min )

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https://www.youtube.com/watch?v=4RUQ_vZ-og0 This Ai can instantly clone your voice and sound exactly like you! It's both amazing and terrifying. The Ai is called ElevenLabs - it has features like text to speech and voice cloning! submitted by /u/Peter3tv33 [link] [comments]  ( 41 min )

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The ResNet paper by Kaiming He et al. does not use dropout for the models. A lot of models prior to ResNets, such as AlexNet and VGGNet gained from using dropout. Why did the authors choose not to use dropout for ResNets ? Is it because they use L2 regularization(weight decay) and batch normalization which are forms of regularization which can substitute dropout regularization ? submitted by /u/V1bicycle [link] [comments]  ( 41 min )

so, I have been learning what DL is and how NN learns to do stuff. From what I understand is the repeated iteration will take random weights and at some point those weights will be kinda perfect for the given task (plz correct me if i'm wrong) Ok, so lets take an example of a task like path finding AI, so we make a NN and train it to go from point A to point B, now it is trained and doing nice and goes to point b perfectly, SO here the weights are set to go from point A to point B right? What if we give the point B somewhere else, How will the AI get perfect weights as the current weights are only perfect for current point B What if we put an obstacle in between point A and B, how will the NN set weights, or is it something like a range of weights which are perfect for any given task for NN ​ IDK if I explained it right, plz comment if you have question about my question, and answer also💕 submitted by /u/Severe-Improvement32 [link] [comments]  ( 42 min )

submitted by /u/how-it-is- [link] [comments]  ( 42 min )

In a recent article, we reviewed dozens of image segmentation algorithms and pointed out mathematically that in many cases the reported performance scores could not be the results of the evaluation methods claimed by the authors. The scores are primary indicators of value and serve as measures of the state-of-the-art to be outperformed by new algorithms. Unfortunately, algorithm rankings turned out to be incorrect in many of 100 papers and the problem is systematic. The pressure to outperform flawed performance scores to get published keeps the trend on-going. How should the community deal with a phenomenon like this: flaws uncovered, factual, undeniable yet on-going? Is the 258th algorithm proposed for a problem more valuable than reproducing a highly cited article? Should it be mandatory to share source code? Is there a merit in developing consistency checks like the ones we did? Any comments are welcome! https://arxiv.org/abs/2111.03853 submitted by /u/AttilaFazekas [link] [comments]  ( 43 min )

Hi all, During the pandemic many software companies transitioned their workforce to "fully-remote" or "partially-remote"; therefore, I was wondering if any reputable institutions offer a remote CS PhD? For context, I know of several individuals who have sorted out remote work with their PIs on a per-person basis (typically after the first 1-2 years of study), but I am not aware of any labs or programs that advertise remote study. Thank you in advance for the responses. Cheers, Matt submitted by /u/TheRealMrMatt [link] [comments]  ( 45 min )

Twitter link to his post: https://twitter.com/alexjc/status/1617152800571416577?s=46&t=CMQT9rK4F1Lt7g7aX2vTJA also important in that regard: The case for 4-bit precision: k-bit Inference Scaling Laws - Tim Dettmers Paper: https://arxiv.org/abs/2212.09720 https://preview.redd.it/7nn0pfhn81fa1.jpg?width=585&format=pjpg&auto=webp&s=2d05998c32fb1eacf56c45e830047381d544f51f https://preview.redd.it/0084vhhn81fa1.jpg?width=598&format=pjpg&auto=webp&s=c9512275714964faa312e8fb2d96ab8ded7dd127 submitted by /u/Singularian2501 [link] [comments]  ( 42 min )

Have you tried ChatGPT? It's super cool but some users are also using it to create automated content submissions and resulting in an increase in AI-generated plagiarism. I have made a tool as a college project to detect content generated using AI. Go ahead and validate your content on AI Content Detector If you are an educator worried about automated content submissions or developers worried about search engine penalties, this tool will help everyone to efficiently detect content generated using AI. submitted by /u/YoutubeStruggle [link] [comments]  ( 44 min )

Let's say I pull a pre-trained LLM off of huggingface. In broad strokes (making whatever assumptions appropriate), what is the relative cost of getting human annotation data versus actually incorporating those data in through training? I've been trying to get this stats and so far the ratio seems to be 2:1, meaning if you spent 10k dollars collecting human annotations, you should expect to spend 5k on compute (finetune, RLHF, ect) but I'd be happy if someone with more experience can chime in. submitted by /u/evanthebouncy [link] [comments]  ( 42 min )

On This page of Meta AI research where they mention AI theory as a topic, they mention that they use techniques from Signal Processing. As someone with an Electrical Engineering background, and interests in Mathematics and AI, I found this very intriguing. Can someone tell me some of the ways signal processing has been used in AI theory? Some papers or some work done? submitted by /u/a_khalid1999 [link] [comments]  ( 47 min )

Please post your questions here instead of creating a new thread. Encourage others who create new posts for questions to post here instead! Thread will stay alive until next one so keep posting after the date in the title. Thanks to everyone for answering questions in the previous thread! submitted by /u/AutoModerator [link] [comments]  ( 43 min )

I’ll try to get into detail about the implementation and difficulties in case it is useful for anyone else trying to do something similar with an applied ML project, so there’s a TLDR at the end if you’d like the short version/result. At the end of last year I convinced myself to start 2023 by creating a side-project that I'd actually finish and deploy and perhaps earn some “passive” income (spoiler, not so passive after all :P), and after some brainstorming I settled on making an automated Youtube channel about finance news since I had just gotten into investing. Shorts seemed to be more manageable and monetization is changing in February so I went with that. My rough initial idea was to get online articles, summarize them, make a basic compilation with some combination of pymovie, open…  ( 47 min )

Someone I work with wrote the below for our internal team (shared with permission) and I thought some here may find it helpful. Recently, I built an app that uses GPT-Index & LangChain to provide an answer to a question based on a piece of text as context. I found GPT-Index to be much easier and straightforward to integrate, but it seems like LangChain has more features and is more powerful. Here's my experience integrating both of them. GPT-Index First thing I did was review their docs to make sure I understood what GPT-Index was, what it could do, and how I was going to use it I went back and forth a couple times figuring out how I was going to use it. Then I found the quickstart guide It seemed like the quickstart guide would work so I followed the guide and after a few tries, …  ( 45 min )

submitted by /u/helliun [link] [comments]  ( 44 min )

Lately, NLP is taking up most of the public space, much of AI news is focused on LLM after Chat-GPT took the spotlight. How do non-NLP people keep up with news? I recently saw a post on reddit where tree models are still being improved. There are other topics too, like the recent trend in Model Explainability which feels to have slowed down. I'd guess this all gets into the more categorical questions which I am wrapping up with 'How do YOU get your ML news'? How does information gathering differ between those in Applied ML and AI researchers (or even further, between those in Business Analytics and those in more 'AI' fields) What sort of interesting things are out there in the world of ML now? (model or non-model related) In looking for Use Cases, does this partially come down to your field? (Finance reads finance news, pharma reads pharma news) ​ Many of the AI/ML Newsletters which I subscribed to when I was less experienced seemed to be full of variety, but as they are all converging to NLP recently maybe it is time to cleanse the subscriptions, or find some new resources. submitted by /u/shaner92 [link] [comments]  ( 44 min )

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I was looking for research that centers around Stable Diffusion models but can be trained with seed images of a specific subject, so that if someone refers to a keyword like "Me" or "I" it would then produce images relative to the keyword of interest. Something like "I am swimming in a beautiful ocean with mountains in the background and wearing a speedo". Then the person subject in the photo would be myself since I referenced "I". submitted by /u/sambrojangles [link] [comments]  ( 43 min )

Saving keystrokes is overrated, but maintaining concentration is underrated. This post is going to look at automating small tasks in order to maintain concentration, not to save time. If a script lets you easily carry out some ancillary task without taking your concentration off your main task, that’s a big win. Maybe the script only […] Small-scale automation first appeared on John D. Cook.  ( 5 min )

Hi, When my agent succeeds to achieve the goal, it receives done = True. But, when it fails in the simulation, for example, it crashes onto the obstacle, should I end the episode and set the done to "True" or is it okay if I just give it to penalty like reward -= 5 at the specific steps? Thanks submitted by /u/sonlightinn [link] [comments]  ( 42 min )

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Hello, I'm currently self-studying math with the goal of learning up to liner-algebra and then returning to school for a BS in mathematics followed by a graduate and then post-graduate degree in a subjecting relating to AI research. Given this goal I was wondering if I should also be self-studying data analysis along with the math. I reason that this might be good since I'd be getting hands-on experience with data and I might even be able to do it as a job while I study. In my math studies I'm currently on Algebra 2 so if I should be learning data analysis, can I start learning it now or would it be better to start after I've learned more advanced math like calculus? submitted by /u/multioutletplug [link] [comments]  ( 42 min )

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Hello everyone, I am currently doing a college research on artificial intelligence and ethics, looking to specify in the field of Bias and fairness in AI. I am looking for someone with some knowledge in the field to conduct a brief interview with in which I ask a couple of questions related to the topic. If you are interested, kindly @ me. Thanks :) submitted by /u/AyanT_01 [link] [comments]  ( 40 min )

I get inaccurate information form ChatGPT when I ask questions in areas where I have a good bit of knowledge. I couple of times it has cited specific books or papers by title and author and, as far as I can tell, the books/papers don't exists. The second time it did this, I ask it why it makes this kind of odd mistakes and it said: "As a language model, my information is based on the text that I have been trained on, and I try to provide the most accurate and relevant information based on that data. However, I am not infallible and sometimes make mistakes or provide information that is inaccurate or out-of-date. I apologize for any inaccuracies in my previous responses, and for any confusion that they may have caused. It's important to know that the information provided by AI models like me should be taken as a starting point for further research and not as the final answer. It's always a good idea to consult with experts or verify information with multiple sources. Again, I apologize for any inaccuracies in my previous statements and any confusion they may have caused." But it is still weird that it would make up specific books and papers, I don't see why a language model would do that. Edit: Maybe the text that it is trained on references specific books and paper that don't exist. And I guess that would be text that are not indexed by Google and other places where I am doing my fact checking such that I cannot figure out where it is getting this stuff. submitted by /u/facinabush [link] [comments]  ( 46 min )

I recently created a website called https://cashwithai.com that is dedicated to helping people learn how to make money using AI like ChatGPT. The website offers a variety of resources, including a QuickStart guide, case studies, and tips and tricks for monetizing AI-generated content. Additionally, I'm offering free 1-on-1 consultations to anyone who is looking for personalized advice and guidance on how to make money with AI. I'm not running ads or charging; I run purely off donations. Let me know if you have any questions! submitted by /u/Chadcash [link] [comments]  ( 41 min )

submitted by /u/SupPandaHugger [link] [comments]  ( 40 min )

I recently had a lot of fun working with my talented peers at IBM Research putting together a point of view to this fascinating question. Wanted to share with you our work and to get feedback from you. ibm.biz/logic_and_information submitted by /u/Consistent_Listen127 [link] [comments]  ( 40 min )

AI will not replace marketers, but marketers who use AI will replace those who don’t. submitted by /u/TheVellerShow [link] [comments]  ( 40 min )

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There has been many advancements in especially in CV, NLP etc. But, I don't see many new AI models that are solving real world problems. There has been a lot of advancements in AI in RL, DL etc but I rarely see new applications in real world. All i see are text to image models, advanced chat bots, better game playing AIs etc. These are definitely amazing, but, I wanna see new stuff which is making a good impact on the real world. Alpha-fold, driverless cars etc are sorta things I am looking for. I don't know if I am just bluntly unaware of new stuff in AI which solves practical problems, or whether not much new stuff is happening in those areas. So, I would be glad if I can know more about how AI is being used in new ways to solve real-wprld problems, or any new AI research trying to tackle a real world problem? Sry if it's a stupid question, and sry for spamming "real world" too much. submitted by /u/Unhappy_Version7565 [link] [comments]  ( 44 min )

Hi guys, I have a technical background and have studied some AI in the past. I'd like to catch up on the latest developments in AI over the last ~10 years. Do you have any recommendations on what to read? I was thinking of maybe trying to get the top most cited papers in the last 10 years and reading them. But I'm not sure where would be the best place to find that. Any suggestions? Thanks in advance. submitted by /u/AlexWD [link] [comments]  ( 41 min )

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Has anyone been able to run a small LLM checkpoint in commodity hardware, like a mini PC? If so, what were your specs? submitted by /u/onedjscream [link] [comments]  ( 42 min )

so it's big pop-sci news that we are running out of quality textual training data (soft-paywalled article, but you get the idea) to produce chinchilla-optimal language models, and they appear to continue learning new abilities as data and parameter size increase. when an infant learns what a cat is, it is not only described, but the infant can see it and understand its form and behavior in a way it can then go on to describe and extrapolate from (even if they are blind, they can touch it and understand its shape and feel its fur). LLMs have to do this the hard way: their generalized understanding of the shape and behaviour of a cat comes from textual descriptions of them (and they would need quite a lot in order to understand!) most of the research i have seen into multiple input transformer models has been with the purpose of task completion (google's embodied language model robot butlers etc, which often use textual descriptions fed to a normal LLM, see https://innermonologue.github.io/ ) or image recognition and understanding (such as in CLIP) but not necessarily applying it to textual completion, which seems like it could benefit from a more visual understanding of the world so, in the medium or short term, to improve performance on text-completion tasks, what are your thoughts on using image training as well as textual to improve generalization for LLMs with fewer text tokens on a new architecture? (also, please excuse any ignorance i may posess: i'm a bit of an armchair ai enjoyer) submitted by /u/Dankmemexplorer [link] [comments]  ( 44 min )

The main reason why this is not in the simple questions thread is the need to includee an image. Here is an image of my generator's and discriminator's gradients being logged onto wandb. As you can see, they have these weird hasms, where the distribution of the gradients becomes very close to zero. These chasms are correlated for the discriminator and generator and seem very regular. Anyone experienced anything like this and maybe has a hunch of what might be the cause? https://preview.redd.it/3qipyez6stea1.png?width=624&format=png&auto=webp&s=f5fb39803082add2fd78979e880e6e784b9e4c0c submitted by /u/Hub_Pli [link] [comments]  ( 43 min )

For regressions, R-squared and Adj. R-Squared are typically considered the primary goodness-of-fit measures. But in many supervised machine-learning models, RMSE is the main measure that I keep running across. For example, decision tree models that I create in R using Rpart do that. So, my question is how to compare the predictive accuracy of OLS regression models that report R-sq to equivalent Rpart regression trees that report RMSE. submitted by /u/bridgeton_man [link] [comments]  ( 43 min )

submitted by /u/yazriel0 [link] [comments]  ( 45 min )

Hi everyone, I made a JupyterLab extension to use OpenAI’s GPT models for code and text completion on your notebook cells. This extension passes your current notebook cell to the GPT API and completes your code/text for you. You can customize the GPT parameters in the Advanced Settings menu. I made this extension when I couldn't find any Copilot/Codex extensions for JupyterLab. It doesn't make sense that ML folks don't have an easy way to use AI generated code in their own tools. VS Code does allow you use Copilot, but I've gotten used to Jupyter and a lot of ML/DS folks I know still prefer using Jupyter over VS code. Installation pip install gpt_jupyterlab GitHub Repo: https://github.com/henshinger/gpt-jupyterlab/ Demo GPT JupyterLab Demo Note: You will need your own OpenAI API Key to use this extension. Would love to get your feedback! submitted by /u/henshinger [link] [comments]  ( 44 min )

I am building an open-source ML observability and refinement toolkit which recently got investment from YCombinator. The tool helps ML practitioners to: 1. Understand how their models are performing in production 2. Catch edge-cases and outliers to help them refine their models 3. Allow them to customise the tool according to their needs (hence, open-source) 4. Bring data-security at the forefront (hence, self hosted) You can check out the project https://github.com/uptrain-ai/uptrain and would love to hear feedback from the community submitted by /u/Vegetable-Skill-9700 [link] [comments]  ( 43 min )

​ https://preview.redd.it/1t7spoqxdsea1.png?width=1920&format=png&auto=webp&s=b4643e418d942260b16019ee250edf56a4336b4b paperai is a semantic search and workflow application for medical/scientific papers. It can be used to take a set of research papers, parse the content and turn it into structured data. paperetl is the underlying library that parses basic metadata such as title, publication and date out of the papers. https://preview.redd.it/5jywynarfsea1.png?width=1084&format=png&auto=webp&s=437b6cdb65fbf12d6d238f84fd94ec4b85dec93b In addition to standard metadata, paperai can also run extractive queries to build additional columns. https://preview.redd.it/8rzfj016esea1.png?width=1138&format=png&auto=webp&s=ccd73c34f0f3001dfe05a0f8c480cf73451dd447 Example notebooks and Docker files can be found on GitHub. paperai | paperetl submitted by /u/davidmezzetti [link] [comments]  ( 43 min )

I want to automate the annotation of a domain-specific text (complicated contracts) by finetuning a BERT model. However the annotated text I've been provided by the domain experts has been sparsely annotated (i.e. paragraph 40-48 has been fully annotated, while 15 other paragraphs only have certain classes annotated for certain words. Most paragraphs have nothing annotated (like 70% of the entire corpus) Another complication is that for 1 class, the entire paragraph should be annotated in this class, while for others it's a single word or a sentence. There are 7 classes in total and in the end, all tokens should be annotated to one of the 7 classes. 6 out of 7 classes are also pretty domain-specific and not something like 'location' or 'person' or POS. I've been thinking about using an annotation framework (i.e. LabelStudio or Prodigy) that supports custom models (i.e. finetuned BERT) and active learning to rapidly increase annotated texts by speeding up the work of human annotators (which are domain experts and usually don't have a lot of time for this). However, it's pretty unclear whether my use case would be support by this, especially with the issue of sparse text. I've also considered making the problem easier by using another model for the specific class that applies to an entire paragraph. And/or by using the fully annotated paragraphs for finetuning and using the sparse paragraphs for validation. A final consideration is using GPT-3, but I'm not sure how/if it is able to classify entire sentences/paragraphs with multiple classes and how the prompt should be formatted as. Any suggestions/ideas? submitted by /u/Background_Claim7907 [link] [comments]  ( 44 min )

https://pypi.org/project/rwkvstic/ Currently supports tensorflow, pytorch, jax Also has support for tensor streaming, 8bit jit-quant and multi-gpu. Run RWKV 7B on 8GB of vram or 14B on 16GB of vram. submitted by /u/hazardous1222 [link] [comments]  ( 42 min )

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One problem with distributed learning with backprop is that the first layer can't update their weights until the computation has travelled all the way down to the last layer and then backpropagated back up. If all your layers are on different machines connected by a high-latency internet connection, this will take a long time. In forward-forward learning, learning is local - each layer operates independently and only needs to communicate with the layers above and below it. The results are almost-but-not-quite as good as backprop. But each layer can immediately update their weights based only on the information they received from the previous layer. Network latency no longer matters; the limit is just the bandwidth of the slowest machine. submitted by /u/currentscurrents [link] [comments]  ( 46 min )

I am looking to buy a laptop for my rl projects and I wanted to know what people in the industry recommended for training models locally and how significant OS, CPU and GPUs really are. submitted by /u/PleasantBase6967 [link] [comments]  ( 43 min )

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Trying to set up a discord bot. submitted by /u/Ah_Books [link] [comments]  ( 40 min )

Time series observations can be seen as realizations of an underlying dynamical system governed by rules that we typically do not know. For time series learning tasks, we need to understand that we fit our model on available data, which is a unique realized history. Training on a single realization often induces severe overfitting lacking generalization. To address this issue, we introduce a general recursive framework for time series augmentation, which we call Recursive Interpolation Method, denoted as RIM. New samples are generated using a recursive interpolation function of all previous values in such a way that the enhanced samples preserve the original inherent time series dynamics. We perform theoretical analysis to characterize the proposed RIM and to guarantee its test performance. We apply RIM to diverse real world time series cases to achieve strong performance over non-augmented data on regression, classification, and reinforcement learning tasks.  ( 2 min )

It is well known that tensor network regression models operate on an exponentially large feature space, but questions remain as to how effectively they are able to utilize this space. Using a polynomial featurization, we propose the interaction decomposition as a tool that can assess the relative importance of different regressors as a function of their polynomial degree. We apply this decomposition to tensor ring and tree tensor network models trained on the MNIST and Fashion MNIST datasets, and find that up to 75% of interaction degrees are contributing meaningfully to these models. We also introduce a new type of tensor network model that is explicitly trained on only a small subset of interaction degrees, and find that these models are able to match or even outperform the full models using only a fraction of the exponential feature space. This suggests that standard tensor network models utilize their polynomial regressors in an inefficient manner, with the lower degree terms being vastly under-utilized.  ( 2 min )

We introduce MusicLM, a model generating high-fidelity music from text descriptions such as "a calming violin melody backed by a distorted guitar riff". MusicLM casts the process of conditional music generation as a hierarchical sequence-to-sequence modeling task, and it generates music at 24 kHz that remains consistent over several minutes. Our experiments show that MusicLM outperforms previous systems both in audio quality and adherence to the text description. Moreover, we demonstrate that MusicLM can be conditioned on both text and a melody in that it can transform whistled and hummed melodies according to the style described in a text caption. To support future research, we publicly release MusicCaps, a dataset composed of 5.5k music-text pairs, with rich text descriptions provided by human experts.  ( 2 min )

In this paper, we provide three applications for $f$-divergences: (i) we introduce Sanov's upper bound on the tail probability of the sum of independent random variables based on super-modular $f$-divergence and show that our generalized Sanov's bound strictly improves over ordinary one, (ii) we consider the lossy compression problem which studies the set of achievable rates for a given distortion and code length. We extend the rate-distortion function using mutual $f$-information and provide new and strictly better bounds on achievable rates in the finite blocklength regime using super-modular $f$-divergences, and (iii) we provide a connection between the generalization error of algorithms with bounded input/output mutual $f$-information and a generalized rate-distortion problem. This connection allows us to bound the generalization error of learning algorithms using lower bounds on the $f$-rate-distortion function. Our bound is based on a new lower bound on the rate-distortion function that (for some examples) strictly improves over previously best-known bounds.  ( 2 min )

Bilevel planning, in which a high-level search over an abstraction of an environment is used to guide low-level decision-making, is an effective approach to solving long-horizon tasks in continuous state and action spaces. Recent work has shown how to enable such bilevel planning by learning action and transition model abstractions in the form of symbolic operators and neural samplers. In this work, we show that existing symbolic operator learning approaches fall short in many natural environments where agent actions tend to cause a large number of irrelevant propositions to change. This is primarily because they attempt to learn operators that optimize the prediction error with respect to observed changes in the propositions. To overcome this issue, we propose to learn operators that only model changes necessary for abstract planning to achieve the specified goal. Experimentally, we show that our approach learns operators that lead to efficient planning across 10 different hybrid robotics domains, including 4 from the challenging BEHAVIOR-100 benchmark, with generalization to novel initial states, goals, and objects.  ( 2 min )

We propose a series of computationally efficient nonparametric tests for the two-sample, independence, and goodness-of-fit problems, using the Maximum Mean Discrepancy (MMD), Hilbert Schmidt Independence Criterion (HSIC), and Kernel Stein Discrepancy (KSD), respectively. Our test statistics are incomplete $U$-statistics, with a computational cost that interpolates between linear time in the number of samples, and quadratic time, as associated with classical $U$-statistic tests. The three proposed tests aggregate over several kernel bandwidths to detect departures from the null on various scales: we call the resulting tests MMDAggInc, HSICAggInc and KSDAggInc. This procedure provides a solution to the fundamental kernel selection problem as we can aggregate a large number of kernels with several bandwidths without incurring a significant loss of test power. For the test thresholds, we derive a quantile bound for wild bootstrapped incomplete $U$-statistics, which is of independent interest. We derive non-asymptotic uniform separation rates for MMDAggInc and HSICAggInc, and quantify exactly the trade-off between computational efficiency and the attainable rates: this result is novel for tests based on incomplete $U$-statistics, to our knowledge. We further show that in the quadratic-time case, the wild bootstrap incurs no penalty to test power over the more widespread permutation-based approach, since both attain the same minimax optimal rates (which in turn match the rates that use oracle quantiles). We support our claims with numerical experiments on the trade-off between computational efficiency and test power. In all three testing frameworks, the linear-time versions of our proposed tests perform at least as well as the current linear-time state-of-the-art tests.  ( 2 min )

Vision-Language (VL) models with the Two-Tower architecture have dominated visual-language representation learning in recent years. Current VL models either use lightweight uni-modal encoders and learn to extract, align and fuse both modalities simultaneously in a deep cross-modal encoder, or feed the last-layer uni-modal representations from the deep pre-trained uni-modal encoders into the top cross-modal encoder. Both approaches potentially restrict vision-language representation learning and limit model performance. In this paper, we propose Bridge-Tower, which introduces multiple bridge layers that build a connection between the top layers of uni-modal encoders and each layer of the cross-modal encoder. This enables effective bottom-up cross-modal alignment and fusion between visual and textual representations of different semantic levels of pre-trained uni-modal encoders in the cross-modal encoder. Pre-trained with only 4M images, Bridge-Tower achieves state-of-the-art performance on various downstream vision-language tasks. In particular, on the VQAv2 test-std set, Bridge-Tower achieves an accuracy of 78.73%, outperforming the previous state-of-the-art model METER by 1.09% with the same pre-training data and almost negligible additional parameters and computational costs. Notably, when further scaling the model, Bridge-Tower achieves an accuracy of 81.15%, surpassing models that are pre-trained on orders-of-magnitude larger datasets. Code and checkpoints are available at \url{https://github.com/microsoft/BridgeTower}.  ( 2 min )

Few-shot Learning (FSL) is aimed to make predictions based on a limited number of samples. Structured data such as knowledge graphs and ontology libraries has been leveraged to benefit the few-shot setting in various tasks. However, the priors adopted by the existing methods suffer from challenging knowledge missing, knowledge noise, and knowledge heterogeneity, which hinder the performance for few-shot learning. In this study, we explore knowledge injection for FSL with pre-trained language models and propose ontology-enhanced prompt-tuning (OntoPrompt). Specifically, we develop the ontology transformation based on the external knowledge graph to address the knowledge missing issue, which fulfills and converts structure knowledge to text. We further introduce span-sensitive knowledge injection via a visible matrix to select informative knowledge to handle the knowledge noise issue. To bridge the gap between knowledge and text, we propose a collective training algorithm to optimize representations jointly. We evaluate our proposed OntoPrompt in three tasks, including relation extraction, event extraction, and knowledge graph completion, with eight datasets. Experimental results demonstrate that our approach can obtain better few-shot performance than baselines.  ( 2 min )

For centuries, scientists have observed nature to understand the laws that govern the physical world. The traditional process of turning observations into physical understanding is slow. Imperfect models are constructed and tested to explain relationships in data. Powerful new algorithms can enable computers to learn physics by observing images and videos. Inspired by this idea, instead of training machine learning models using physical quantities, we used images, that is, pixel information. For this work, and as a proof of concept, the physics of interest are wind-driven spatial patterns. These phenomena include features in Aeolian dunes and volcanic ash deposition, wildfire smoke, and air pollution plumes. We use computer model simulations of spatial deposition patterns to approximate images from a hypothetical imaging device whose outputs are red, green, and blue (RGB) color images with channel values ranging from 0 to 255. In this paper, we explore deep convolutional neural network-based autoencoders to exploit relationships in wind-driven spatial patterns, which commonly occur in geosciences, and reduce their dimensionality. Reducing the data dimension size with an encoder enables training deep, fully connected neural network models linking geographic and meteorological scalar input quantities to the encoded space. Once this is achieved, full spatial patterns are reconstructed using the decoder. We demonstrate this approach on images of spatial deposition from a pollution source, where the encoder compresses the dimensionality to 0.02% of the original size, and the full predictive model performance on test data achieves a normalized root mean squared error of 8%, a figure of merit in space of 94% and a precision-recall area under the curve of 0.93.  ( 3 min )

Despite recent success in large language model (LLM) reasoning, LLMs struggle with hierarchical multi-step reasoning tasks like generating complex programs. For these tasks, humans often start with a high-level algorithmic design and implement each part gradually. We introduce Parsel, a framework enabling automatic implementation and validation of complex algorithms with code LLMs, taking hierarchical function descriptions in natural language as input. We show that Parsel can be used across domains requiring hierarchical reasoning, including program synthesis, robotic planning, and theorem proving. We show that LLMs generating Parsel solve more competition-level problems in the APPS dataset, resulting in pass rates that are over 75% higher than prior results from directly sampling AlphaCode and Codex, while often using a smaller sample budget. We also find that LLM-generated robotic plans using Parsel as an intermediate language are more than twice as likely to be considered accurate than directly generated plans. Lastly, we explore how Parsel addresses LLM limitations and discuss how Parsel may be useful for human programmers.  ( 2 min )

Despite the remarkable performance and generalization levels of deep learning models in a wide range of artificial intelligence tasks, it has been demonstrated that these models can be easily fooled by the addition of imperceptible yet malicious perturbations to natural inputs. These altered inputs are known in the literature as adversarial examples. In this paper, we propose a novel probabilistic framework to generalize and extend adversarial attacks in order to produce a desired probability distribution for the classes when we apply the attack method to a large number of inputs. This novel attack paradigm provides the adversary with greater control over the target model, thereby exposing, in a wide range of scenarios, threats against deep learning models that cannot be conducted by the conventional paradigms. We introduce four different strategies to efficiently generate such attacks, and illustrate our approach by extending multiple adversarial attack algorithms. We also experimentally validate our approach for the spoken command classification task and the Tweet emotion classification task, two exemplary machine learning problems in the audio and text domain, respectively. Our results demonstrate that we can closely approximate any probability distribution for the classes while maintaining a high fooling rate and even prevent the attacks from being detected by label-shift detection methods.  ( 2 min )

Adaptive gradient methods are the method of choice for optimization in machine learning and used to train the largest deep models. In this paper we study the problem of learning a local preconditioner, that can change as the data is changing along the optimization trajectory. We propose an adaptive gradient method that has provable adaptive regret guarantees vs. the best local preconditioner. To derive this guarantee, we prove a new adaptive regret bound in online learning that improves upon previous adaptive online learning methods. We demonstrate the robustness of our method in automatically choosing the optimal learning rate schedule for popular benchmarking tasks in vision and language domains. Without the need to manually tune a learning rate schedule, our method can, in a single run, achieve comparable and stable task accuracy as a fine-tuned optimizer.  ( 2 min )

The two key characteristics of a normalizing flow is that it is invertible (in particular, dimension preserving) and that it monitors the amount by which it changes the likelihood of data points as samples are propagated along the network. Recently, multiple generalizations of normalizing flows have been introduced that relax these two conditions. On the other hand, neural networks only perform a forward pass on the input, there is neither a notion of an inverse of a neural network nor is there one of its likelihood contribution. In this paper we argue that certain neural network architectures can be enriched with a stochastic inverse pass and that their likelihood contribution can be monitored in a way that they fall under the generalized notion of a normalizing flow mentioned above. We term this enrichment flowification. We prove that neural networks only containing linear layers, convolutional layers and invertible activations such as LeakyReLU can be flowified and evaluate them in the generative setting on image datasets.  ( 2 min )

The critical challenge of Semi-Supervised Learning (SSL) is how to effectively leverage the limited labeled data and massive unlabeled data to improve the model's generalization performance. In this paper, we first revisit the popular pseudo-labeling methods via a unified sample weighting formulation and demonstrate the inherent quantity-quality trade-off problem of pseudo-labeling with thresholding, which may prohibit learning. To this end, we propose SoftMatch to overcome the trade-off by maintaining both high quantity and high quality of pseudo-labels during training, effectively exploiting the unlabeled data. We derive a truncated Gaussian function to weight samples based on their confidence, which can be viewed as a soft version of the confidence threshold. We further enhance the utilization of weakly-learned classes by proposing a uniform alignment approach. In experiments, SoftMatch shows substantial improvements across a wide variety of benchmarks, including image, text, and imbalanced classification.  ( 2 min )

We aim to diagnose the potential biases in image classifiers. To this end, prior works manually labeled biased attributes or visualized biased features, which need high annotation costs or are often ambiguous to interpret. Instead, we leverage two types (generative and discriminative) of pre-trained vision-language models to describe the visual bias as a word. Specifically, we propose bias-to-text (B2T), which generates captions of the mispredicted images using a pre-trained captioning model to extract the common keywords that may describe visual biases. Then, we categorize the bias type as spurious correlation or majority bias by checking if it is specific or agnostic to the class, based on the similarity of class-wise mispredicted images and the keyword upon a pre-trained vision-language joint embedding space, e.g., CLIP. We demonstrate that the proposed simple and intuitive scheme can recover well-known gender and background biases, and discover novel ones in real-world datasets. Moreover, we utilize B2T to compare the classifiers using different architectures or training methods. Finally, we show that one can obtain debiased classifiers using the B2T bias keywords and CLIP, in both zero-shot and full-shot manners, without using any human annotation on the bias.  ( 2 min )

Most of the literature on learning in games has focused on the restrictive setting where the underlying repeated game does not change over time. Much less is known about the convergence of no-regret learning algorithms in dynamic multiagent settings. In this paper, we characterize the convergence of \emph{optimistic gradient descent (OGD)} in time-varying games by drawing a strong connection with \emph{dynamic regret}. Our framework yields sharp convergence bounds for the equilibrium gap of OGD in zero-sum games parameterized on the \emph{minimal} first-order variation of the Nash equilibria and the second-order variation of the payoff matrices, subsuming known results for static games. Furthermore, we establish improved \emph{second-order} variation bounds under strong convexity-concavity, as long as each game is repeated multiple times. Our results also apply to time-varying \emph{general-sum} multi-player games via a bilinear formulation of correlated equilibria, which has novel implications for meta-learning and for obtaining refined variation-dependent regret bounds, addressing questions left open in prior papers. Finally, we leverage our framework to also provide new insights on dynamic regret guarantees in static games.  ( 2 min )

Representation learning in the form of semantic embeddings has been successfully applied to a variety of tasks in natural language processing and knowledge graphs. Recently, there has been growing interest in developing similar methods for learning embeddings of entire ontologies. We propose Box$^2$EL, a novel method for representation learning of ontologies in the Description Logic EL++, which represents both concepts and roles as boxes (i.e. axis-aligned hyperrectangles), such that the logical structure of the ontology is preserved. We theoretically prove the soundness of our model and conduct an extensive empirical evaluation, in which we achieve state-of-the-art results in subsumption prediction, link prediction, and deductive reasoning. As part of our evaluation, we introduce a novel benchmark for evaluating EL++ embedding models on predicting subsumptions involving both atomic and complex concepts.  ( 2 min )

Counterfactual explanations play an important role in detecting bias and improving the explainability of data-driven classification models. A counterfactual explanation (CE) is a minimal perturbed data point for which the decision of the model changes. Most of the existing methods can only provide one CE, which may not be achievable for the user. In this work we derive an iterative method to calculate robust CEs, i.e. CEs that remain valid even after the features are slightly perturbed. To this end, our method provides a whole region of CEs allowing the user to choose a suitable recourse to obtain a desired outcome. We use algorithmic ideas from robust optimization and prove convergence results for the most common machine learning methods including logistic regression, decision trees, random forests, and neural networks. Our experiments show that our method can efficiently generate globally optimal robust CEs for a variety of common data sets and classification models.  ( 2 min )

A large class of inverse problems for PDEs are only well-defined as mappings from operators to functions. Existing operator learning frameworks map functions to functions and need to be modified to learn inverse maps from data. We propose a novel architecture termed Neural Inverse Operators (NIOs) to solve these PDE inverse problems. Motivated by the underlying mathematical structure, NIO is based on a suitable composition of DeepONets and FNOs to approximate mappings from operators to functions. A variety of experiments are presented to demonstrate that NIOs significantly outperform baselines and solve PDE inverse problems robustly, accurately and are several orders of magnitude faster than existing direct and PDE-constrained optimization methods.  ( 2 min )

This paper attempts to present the stochastic differential equations of diffusion models in a manner that is accessible to a broad audience. The diffusion process is defined over a population density in R^d. Of particular interest is a population of images. In a diffusion model one first defines a diffusion process that takes a sample from the population and gradually adds noise until only noise remains. The fundamental idea is to sample from the population by a reverse-diffusion process mapping pure noise to a population sample. The diffusion process is defined independent of any ``interpretation'' but can be analyzed using the mathematics of variational auto-encoders (the ``VAE interpretation'') or the Fokker-Planck equation (the ``score-matching intgerpretation''). Both analyses yield reverse-diffusion methods involving the score function. The Fokker-Planck analysis yields a family of reverse-diffusion SDEs parameterized by any desired level of reverse-diffusion noise including zero (deterministic reverse-diffusion). The VAE analysis yields the reverse-diffusion SDE at the same noise level as the diffusion SDE. The VAE analysis also yields a useful expression for computing the population probabilities of a given point (image). This formula for the probability of a given point does not seem to follow naturally from the Fokker-Planck analysis. Much, but apparently not all, of the mathematics presented here can be found in the literature. Attributions are given at the end of the paper.  ( 2 min )

Reinforcement learning (RL) is applied in a wide variety of fields. RL enables agents to learn tasks autonomously by interacting with the environment. The more critical the tasks are, the higher the demand for the robustness of the RL systems. Causal RL combines RL and causal inference to make RL more robust. Causal RL agents use a causal representation to capture the invariant causal mechanisms that can be transferred from one task to another. Currently, there is limited research in Causal RL, and existing solutions are usually not complete or feasible for real-world applications. In this work, we propose CausalCF, the first complete Causal RL solution incorporating ideas from Causal Curiosity and CoPhy. Causal Curiosity provides an approach for using interventions, and CoPhy is modified to enable the RL agent to perform counterfactuals. We apply CausalCF to complex robotic tasks and show that it improves the RL agent's robustness using a realistic simulation environment called CausalWorld.  ( 2 min )

Cyber-crimes have become a multi-billion-dollar industry in the recent years. Most cybercrimes/attacks involve deploying some type of malware. Malware that viciously targets every industry, every sector, every enterprise and even individuals has shown its capabilities to take entire business organizations offline and cause significant financial damage in billions of dollars annually. Malware authors are constantly evolving in their attack strategies and sophistication and are developing malware that is difficult to detect and can lay dormant in the background for quite some time in order to evade security controls. Given the above argument, Traditional approaches to malware detection are no longer effective. As a result, deep learning models have become an emerging trend to detect and classify malware. This paper proposes a new convolutional deep learning neural network to accurately and effectively detect malware with high precision. This paper is different than most other papers in the literature in that it uses an expert data science approach by developing a convolutional neural network from scratch to establish a baseline of the performance model first, explores and implements an improvement model from the baseline model, and finally it evaluates the performance of the final model. The baseline model initially achieves 98% accurate rate but after increasing the depth of the CNN model, its accuracy reaches 99.183 which outperforms most of the CNN models in the literature. Finally, to further solidify the effectiveness of this CNN model, we use the improved model to make predictions on new malware samples within our dataset.  ( 2 min )

Although a typical autopilot system far surpasses humans in term of sensing accuracy, performance stability and response agility, such a system is still far behind humans in the wisdom of understanding an unfamiliar environment with creativity, adaptivity and resiliency. Current AD brains are basically expert systems featuring logical computations, which resemble the thinking flow of a left brain working at tactical level. A right brain is needed to upgrade the safety of automated driving vehicle onto next generation by making intuitive strategical judgements that can supervise the tactical action planning. In this work, we present the concept of an Automated Driving Strategical Brain (ADSB): a framework of a scene perception and scene safety evaluation system that works at a higher abstraction level, incorporating experience referencing, common-sense inferring and goal-and-value judging capabilities, to provide a contextual perspective for decision making within automated driving planning. The ADSB brain architecture is made up of the Experience Referencing Engine (ERE), the Common-sense Referencing Engine (CIE) and the Goal and Value Keeper (GVK). 1,614,748 cases from FARS/CRSS database of NHTSA in the period 1975 to 2018 are used for the training of ERE model. The kernel of CIE is a trained model, COMET-BART by ATOMIC, which can be used to provide directional advice when tactical-level environmental perception conclusions are ambiguous; it can also use future scenario models to remind tactical-level decision systems to plan ahead of a perceived hazard scene. GVK can take in any additional expert-hand-written rules that are of qualitative nature. Moreover, we believe that with good scalability, the ADSB approach provides a potential solution to the problem of long-tail corner cases encountered in the validation of a rule-based planning algorithm.  ( 2 min )

Efficiently and flexibly estimating treatment effect heterogeneity is an important task in a wide variety of settings ranging from medicine to marketing, and there are a considerable number of promising conditional average treatment effect estimators currently available. These, however, typically rely on the assumption that the measured covariates are enough to justify conditional exchangeability. We propose the P-learner, motivated by the R-learner, a tailored two-stage loss function for learning heterogeneous treatment effects in settings where exchangeability given observed covariates is an implausible assumption, and we wish to rely on proxy variables for causal inference. Our proposed estimator can be implemented by off-the-shelf loss-minimizing machine learning methods, which in the case of kernel regression satisfies an oracle bound on the estimated error as long as the nuisance components are estimated reasonably well.  ( 2 min )

Hyperdimensional computing (HDC) uses binary vectors of high dimensions to perform classification. Due to its simplicity and massive parallelism, HDC can be highly energy-efficient and well-suited for resource-constrained platforms. However, in trading off orthogonality with efficiency, hypervectors may use tens of thousands of dimensions. In this paper, we will examine the necessity for such high dimensions. In particular, we give a detailed theoretical analysis of the relationship among dimensions of hypervectors, accuracy, and orthogonality. The main conclusion of this study is that a much lower dimension, typically less than 100, can also achieve similar or even higher detecting accuracy compared with other state-of-the-art HDC models. Based on this insight, we propose a suite of novel techniques to build HDC models that use binary hypervectors of dimensions that are orders of magnitude smaller than those found in the state-of-the-art HDC models, yet yield equivalent or even improved accuracy and efficiency. For image classification, we achieved an HDC accuracy of 96.88\% with a dimension of only 32 on the MNIST dataset. We further explore our methods on more complex datasets like CIFAR-10 and show the limits of HDC computing.  ( 2 min )

It is challenging to guide neural network (NN) learning with prior knowledge. In contrast, many known properties, such as spatial smoothness or seasonality, are straightforward to model by choosing an appropriate kernel in a Gaussian process (GP). Many deep learning applications could be enhanced by modeling such known properties. For example, convolutional neural networks (CNNs) are frequently used in remote sensing, which is subject to strong seasonal effects. We propose to blend the strengths of deep learning and the clear modeling capabilities of GPs by using a composite kernel that combines a kernel implicitly defined by a neural network with a second kernel function chosen to model known properties (e.g., seasonality). We implement this idea by combining a deep network and an efficient mapping based on the Nystrom approximation, which we call Implicit Composite Kernel (ICK). We then adopt a sample-then-optimize approach to approximate the full GP posterior distribution. We demonstrate that ICK has superior performance and flexibility on both synthetic and real-world data sets. We believe that ICK framework can be used to include prior information into neural networks in many applications.  ( 2 min )

We propose a clustering method that involves chaining four known techniques into a pipeline yielding an algorithm with stronger recovery guarantees than any of the four components separately. Given $n$ points in $\mathbb R^d$, the first component of our pipeline, which we call leapfrog distances, is reminiscent of density-based clustering, yielding an $n\times n$ distance matrix. The leapfrog distances are then translated to new embeddings using multidimensional scaling and spectral methods, two other known techniques, yielding new embeddings of the $n$ points in $\mathbb R^{d'}$, where $d'$ satisfies $d'\ll d$ in general. Finally, sum-of-norms (SON) clustering is applied to the re-embedded points. Although the fourth step (SON clustering) can in principle be replaced by any other clustering method, our focus is on provable guarantees of recovery of underlying structure. Therefore, we establish that the re-embedding improves recovery SON clustering, since SON clustering is a well-studied method that already has provable guarantees.  ( 2 min )

Deep graph generative modeling has proven capable of learning the distribution of complex, multi-scale structures characterizing real-world graphs. However, one of the main limitations of existing methods is their large output space, which limits generation scalability and hinders accurate modeling of the underlying distribution. To overcome these limitations, we propose a novel approach that significantly reduces the output space of existing graph generative models. Specifically, starting from the observation that many real-world graphs have low graph bandwidth, we restrict graph bandwidth during training and generation. Our strategy improves both generation scalability and quality without increasing architectural complexity or reducing expressiveness. Our approach is compatible with existing graph generative methods, and we describe its application to both autoregressive and one-shot models. We extensively validate our strategy on synthetic and real datasets, including molecular graphs. Our experiments show that, in addition to improving generation efficiency, our approach consistently improves generation quality and reconstruction accuracy. The implementation is made available.  ( 2 min )

Federated Learning by nature is susceptible to low-quality, corrupted, or even malicious data that can severely degrade the quality of the learned model. Traditional techniques for data valuation cannot be applied as the data is never revealed. We present a novel technique for filtering, and scoring data based on a practical influence approximation (`lazy' influence) that can be implemented in a privacy-preserving manner. Each participant uses his own data to evaluate the influence of another participant's batch, and reports to the center an obfuscated score using differential privacy. Our technique allows for highly effective filtering of corrupted data in a variety of applications. Importantly, we show that most of the corrupted data can be filtered out (recall of $>90\%$, and even up to $100\%$), even under really strong privacy guarantees ($\varepsilon \leq 1$).  ( 2 min )

Our work advances an approach for predicting hate speech in social media, drawing out the critical need to consider the discussions that follow a post to successfully detect when hateful discourse may arise. Using graph transformer networks, coupled with modelling attention and BERT-level natural language processing, our approach can capture context and anticipate upcoming anti-social behaviour. In this paper, we offer a detailed qualitative analysis of this solution for hate speech detection in social networks, leading to insights into where the method has the most impressive outcomes in comparison with competitors and identifying scenarios where there are challenges to achieving ideal performance. Included is an exploration of the kinds of posts that permeate social media today, including the use of hateful images. This suggests avenues for extending our model to be more comprehensive. A key insight is that the focus on reasoning about the concept of context positions us well to be able to support multi-modal analysis of online posts. We conclude with a reflection on how the problem we are addressing relates especially well to the theme of dynamic change, a critical concern for all AI solutions for social impact. We also comment briefly on how mental health well-being can be advanced with our work, through curated content attuned to the extent of hate in posts.  ( 2 min )

We provide an optimization-based framework to perform counterfactual analysis in a dynamic model with hidden states. Our framework is grounded in the "abduction, action, and prediction" approach to answer counterfactual queries and handles two key challenges where (1) the states are hidden and (2) the model is dynamic. Recognizing the lack of knowledge on the underlying causal mechanism and the possibility of infinitely many such mechanisms, we optimize over this space and compute upper and lower bounds on the counterfactual quantity of interest. Our work brings together ideas from causality, state-space models, simulation, and optimization, and we apply it on a breast cancer case study. To the best of our knowledge, we are the first to compute lower and upper bounds on a counterfactual query in a dynamic latent-state model.  ( 2 min )

There has recently been growing interest in the automatic generation of cooking recipes that satisfy some form of dietary restrictions, thanks in part to the availability of online recipe data. Prior studies have used pre-trained language models, or relied on small paired recipe data (e.g., a recipe paired with a similar one that satisfies a dietary constraint). However, pre-trained language models generate inconsistent or incoherent recipes, and paired datasets are not available at scale. We address these deficiencies with RecipeCrit, a hierarchical denoising auto-encoder that edits recipes given ingredient-level critiques. The model is trained for recipe completion to learn semantic relationships within recipes. Our work's main innovation is our unsupervised critiquing module that allows users to edit recipes by interacting with the predicted ingredients; the system iteratively rewrites recipes to satisfy users' feedback. Experiments on the Recipe1M recipe dataset show that our model can more effectively edit recipes compared to strong language-modeling baselines, creating recipes that satisfy user constraints and are more correct, serendipitous, coherent, and relevant as measured by human judges.  ( 2 min )

We consider the Scale-Free Adversarial Multi-Armed Bandit (MAB) problem with unrestricted feedback delays. In contrast to the standard assumption that all losses are $[0,1]$-bounded, in our setting, losses can fall in a general bounded interval $[-L, L]$, unknown to the agent beforehand. Furthermore, the feedback of each arm pull can experience arbitrary delays. We propose a novel approach named Scale-Free Delayed INF (SFD-INF) for this novel setting, which combines a recent "convex combination trick" together with a novel doubling and skipping technique. We then present two instances of SFD-INF, each with carefully designed delay-adapted learning scales. The first one SFD-TINF uses $\frac 12$-Tsallis entropy regularizer and can achieve $\widetilde{\mathcal O}(\sqrt{K(D+T)}L)$ regret when the losses are non-negative, where $K$ is the number of actions, $T$ is the number of steps, and $D$ is the total feedback delay. This bound nearly matches the $\Omega((\sqrt{KT}+\sqrt{D\log K})L)$ lower-bound when regarding $K$ as a constant independent of $T$. The second one, SFD-LBINF, works for general scale-free losses and achieves a small-loss style adaptive regret bound $\widetilde{\mathcal O}(\sqrt{K\mathbb{E}[\tilde{\mathfrak L}_T^2]}+\sqrt{KDL})$, which falls to the $\widetilde{\mathcal O}(\sqrt{K(D+T)}L)$ regret in the worst case and is thus more general than SFD-TINF despite a more complicated analysis and several extra logarithmic dependencies. Moreover, both instances also outperform the existing algorithms for non-delayed (i.e., $D=0$) scale-free adversarial MAB problems, which can be of independent interest.  ( 2 min )

In a Fisher market, agents (users) spend a budget of (artificial) currency to buy goods that maximize their utilities while a central planner sets prices on capacity-constrained goods such that the market clears. However, the efficacy of pricing schemes in achieving an equilibrium outcome in Fisher markets typically relies on complete knowledge of users' budgets and utilities and requires that transactions happen in a static market wherein all users are present simultaneously. As a result, we study an online variant of Fisher markets, wherein budget-constrained users with privately known utility and budget parameters, drawn i.i.d. from a distribution $\mathcal{D}$, enter the market sequentially. In this setting, we develop an algorithm that adjusts prices solely based on observations of user consumption, i.e., revealed preference feedback, and achieves a regret and capacity violation of $O(\sqrt{n})$, where $n$ is the number of users and the good capacities scale as $O(n)$. Here, our regret measure is the optimality gap in the objective of the Eisenberg-Gale program between an online algorithm and an offline oracle with complete information on users' budgets and utilities. To establish the efficacy of our approach, we show that any uniform (static) pricing algorithm, including one that sets expected equilibrium prices with complete knowledge of the distribution $\mathcal{D}$, cannot achieve both a regret and constraint violation of less than $\Omega(\sqrt{n})$. While our revealed preference algorithm requires no knowledge of the distribution $\mathcal{D}$, we show that if $\mathcal{D}$ is known, then an adaptive variant of expected equilibrium pricing achieves $O(\log(n))$ regret and constant capacity violation for discrete distributions. Finally, we present numerical experiments to demonstrate the performance of our revealed preference algorithm relative to several benchmarks.  ( 3 min )

Adversarial training (i.e., training on adversarially perturbed input data) is a well-studied method for making neural networks robust to potential adversarial attacks during inference. However, the improved robustness does not come for free but rather is accompanied by a decrease in overall model accuracy and performance. Recent work has shown that, in practical robot learning applications, the effects of adversarial training do not pose a fair trade-off but inflict a net loss when measured in holistic robot performance. This work revisits the robustness-accuracy trade-off in robot learning by systematically analyzing if recent advances in robust training methods and theory in conjunction with adversarial robot learning, are capable of making adversarial training suitable for real-world robot applications. We evaluate three different robot learning tasks ranging from autonomous driving in a high-fidelity environment amenable to sim-to-real deployment to mobile robot navigation and gesture recognition. Our results demonstrate that, while these techniques make incremental improvements on the trade-off on a relative scale, the negative impact on the nominal accuracy caused by adversarial training still outweighs the improved robustness by an order of magnitude. We conclude that although progress is happening, further advances in robust learning methods are necessary before they can benefit robot learning tasks in practice.  ( 2 min )

Privacy-preserving machine learning enables the training of models on decentralized datasets without the need to reveal the data, both on horizontal and vertically partitioned data. However, it relies on specialized techniques and algorithms to perform the necessary computations. The privacy preserving scalar product protocol, which enables the dot product of vectors without revealing them, is one popular example for its versatility. Unfortunately, the solutions currently proposed in the literature focus mainly on two-party scenarios, even though scenarios with a higher number of data parties are becoming more relevant. For example when performing analyses that require counting the number of samples which fulfill certain criteria defined across various sites, such as calculating the information gain at a node in a decision tree. In this paper we propose a generalization of the protocol for an arbitrary number of parties, based on an existing two-party method. Our proposed solution relies on a recursive resolution of smaller scalar products. After describing our proposed method, we discuss potential scalability issues. Finally, we describe the privacy guarantees and identify any concerns, as well as comparing the proposed method to the original solution in this aspect.  ( 2 min )

Inertial sensor-based human activity recognition (HAR) is the base of many human-centered mobile applications. Deep learning-based fine-grained HAR models enable accurate classification in various complex application scenarios. Nevertheless, the large storage and computational overhead of the existing fine-grained deep HAR models hinder their widespread deployment on resource-limited platforms. Inspired by the knowledge distillation's reasonable model compression and potential performance improvement capability, we design a multi-level HAR modeling pipeline called Stage-Logits-Memory Distillation (SMLDist) based on the widely-used MobileNet. By paying more attention to the frequency-related features during the distillation process, the SMLDist improves the HAR classification robustness of the students. We also propose an auto-search mechanism in the heterogeneous classifiers to improve classification performance. Extensive simulation results demonstrate that SMLDist outperforms various state-of-the-art HAR frameworks in accuracy and F1 macro score. The practical evaluation of the Jetson Xavier AGX platform shows that the SMLDist model is both energy-efficient and computation-efficient. These experiments validate the reasonable balance between the robustness and efficiency of the proposed model. The comparative experiments of knowledge distillation on six public datasets also demonstrate that the SMLDist outperforms other advanced knowledge distillation methods of students' performance, which verifies the good generalization of the SMLDist on other classification tasks, including but not limited to HAR.  ( 2 min )

Artificial intelligence and machine learning algorithms have become ubiquitous. Although they offer a wide range of benefits, their adoption in decision-critical fields is limited by their lack of interpretability, particularly with textual data. Moreover, with more data available than ever before, it has become increasingly important to explain automated predictions. Generally, users find it difficult to understand the underlying computational processes and interact with the models, especially when the models fail to generate the outcomes or explanations, or both, correctly. This problem highlights the growing need for users to better understand the models' inner workings and gain control over their actions. This dissertation focuses on two fundamental challenges of addressing this need. The first involves explanation generation: inferring high-quality explanations from text documents in a scalable and data-driven manner. The second challenge consists in making explanations actionable, and we refer to it as critiquing. This dissertation examines two important applications in natural language processing and recommendation tasks. Overall, we demonstrate that interpretability does not come at the cost of reduced performance in two consequential applications. Our framework is applicable to other fields as well. This dissertation presents an effective means of closing the gap between promise and practice in artificial intelligence.  ( 2 min )

Even though recent years have seen many attacks exposing severe vulnerabilities in Federated Learning (FL), a holistic understanding of what enables these attacks and how they can be mitigated effectively is still lacking. In this work, we demystify the inner workings of existing (targeted) attacks. We provide new insights into why these attacks are possible and why a definitive solution to FL robustness is challenging. We show that the need for ML algorithms to memorize tail data has significant implications for FL integrity. This phenomenon has largely been studied in the context of privacy; our analysis sheds light on its implications for ML integrity. We show that certain classes of severe attacks can be mitigated effectively by enforcing constraints such as norm bounds on clients' updates. We investigate how to efficiently incorporate these constraints into secure FL protocols in the single-server setting. Based on this, we propose RoFL, a new secure FL system that extends secure aggregation with privacy-preserving input validation. Specifically, RoFL can enforce constraints such as $L_2$ and $L_\infty$ bounds on high-dimensional encrypted model updates.  ( 2 min )

Creating presentation slides is a critical but time-consuming task for data scientists. While researchers have proposed many AI techniques to lift data scientists' burden on data preparation and model selection, few have targeted the presentation creation task. Based on the needs identified from a formative study, this paper presents NB2Slides, an AI system that facilitates users to compose presentations of their data science work. NB2Slides uses deep learning methods as well as example-based prompts to generate slides from computational notebooks, and take users' input (e.g., audience background) to structure the slides. NB2Slides also provides an interactive visualization that links the slides with the notebook to help users further edit the slides. A follow-up user evaluation with 12 data scientists shows that participants believed NB2Slides can improve efficiency and reduces the complexity of creating slides. Yet, participants questioned the future of full automation and suggested a human-AI collaboration paradigm.  ( 2 min )

We study fine-grained error bounds for differentially private algorithms for counting under continual observation. Our main insight is that the matrix mechanism when using lower-triangular matrices can be used in the continual observation model. More specifically, we give an explicit factorization for the counting matrix $M_\mathsf{count}$ and upper bound the error explicitly. We also give a fine-grained analysis, specifying the exact constant in the upper bound. Our analysis is based on upper and lower bounds of the {\em completely bounded norm} (cb-norm) of $M_\mathsf{count}$. Along the way, we improve the best-known bound of 28 years by Mathias (SIAM Journal on Matrix Analysis and Applications, 1993) on the cb-norm of $M_\mathsf{count}$ for a large range of the dimension of $M_\mathsf{count}$. Furthermore, we are the first to give concrete error bounds for various problems under continual observation such as binary counting, maintaining a histogram, releasing an approximately cut-preserving synthetic graph, many graph-based statistics, and substring and episode counting. Finally, we note that our result can be used to get a fine-grained error bound for non-interactive local learning {and the first lower bounds on the additive error for $(\epsilon,\delta)$-differentially-private counting under continual observation.} Subsequent to this work, Henzinger et al. (SODA2023) showed that our factorization also achieves fine-grained mean-squared error.  ( 2 min )

We propose Banker-OMD, a novel framework generalizing the classical Online Mirror Descent (OMD) technique in online learning algorithm design. Banker-OMD allows algorithms to robustly handle delayed feedback, and offers a general methodology for achieving $\tilde{O}(\sqrt{T} + \sqrt{D})$-style regret bounds in various delayed-feedback online learning tasks, where $T$ is the time horizon length and $D$ is the total feedback delay. We demonstrate the power of Banker-OMD with applications to three important bandit scenarios with delayed feedback, including delayed adversarial Multi-armed bandits (MAB), delayed adversarial linear bandits, and a novel delayed best-of-both-worlds MAB setting. Banker-OMD achieves nearly-optimal performance in all the three settings. In particular, it leads to the first delayed adversarial linear bandit algorithm achieving $\tilde{O}(\text{poly}(n)(\sqrt{T} + \sqrt{D}))$ regret.  ( 2 min )

This paper puts forward the concept that learning to take safe actions in unknown environments, even with probability one guarantees, can be achieved without the need for an unbounded number of exploratory trials. This is indeed possible, provided that one is willing to navigate trade-offs between optimality, level of exposure to unsafe events, and the maximum detection time of unsafe actions. We illustrate this concept in two complementary settings. We first focus on the canonical multi-armed bandit problem and study the intrinsic trade-offs of learning safety in the presence of uncertainty. Under mild assumptions on sufficient exploration, we provide an algorithm that provably detects all unsafe machines in an (expected) finite number of rounds. The analysis also unveils a trade-off between the number of rounds needed to secure the environment and the probability of discarding safe machines. We then consider the problem of finding optimal policies for a Markov Decision Process (MDP) with almost sure constraints. We show that the action-value function satisfies a barrier-based decomposition which allows for the identification of feasible policies independently of the reward process. Using this decomposition, we develop a Barrier-learning algorithm, that identifies such unsafe state-action pairs in a finite expected number of steps. Our analysis further highlights a trade-off between the time lag for the underlying MDP necessary to detect unsafe actions, and the level of exposure to unsafe events. Simulations corroborate our theoretical findings, further illustrating the aforementioned trade-offs, and suggesting that safety constraints can speed up the learning process.  ( 2 min )

Ensembles of machine learning models have been well established as a powerful method of improving performance over a single model. Traditionally, ensembling algorithms train their base learners independently or sequentially with the goal of optimizing their joint performance. In the case of deep ensembles of neural networks, we are provided with the opportunity to directly optimize the true objective: the joint performance of the ensemble as a whole. Surprisingly, however, directly minimizing the loss of the ensemble appears to rarely be applied in practice. Instead, most previous research trains individual models independently with ensembling performed post hoc. In this work, we show that this is for good reason - joint optimization of ensemble loss results in degenerate behavior. We approach this problem by decomposing the ensemble objective into the strength of the base learners and the diversity between them. We discover that joint optimization results in a phenomenon in which base learners collude to artificially inflate their apparent diversity. This pseudo-diversity fails to generalize beyond the training data, causing a larger generalization gap. We proceed to demonstrate the practical implications of this effect finding that, in some cases, a balance between independent training and joint optimization can improve performance over the former while avoiding the degeneracies of the latter.  ( 2 min )

Multi-task Imitation Learning (MIL) aims to train a policy capable of performing a distribution of tasks, which is essential for general-purpose robots, based on multi-task expert demonstrations. Existing MIL algorithms suffer from low data efficiency and poor performance on complex long-horizontal tasks. We develop Multi-task Hierarchical Adversarial Inverse Reinforcement Learning (MH-AIRL) to learn hierarchically-structured multi-task policies, which is more beneficial for compositional tasks with long horizons and has higher expert data efficiency through identifying and transferring reusable basic skills across tasks. To realize this, MH-AIRL effectively synthesizes context-based multi-task learning, AIRL (an IL approach), and hierarchical policy learning. Further, MH-AIRL can be adopted to demonstrations without the task or skill annotations (i.e., state-action pairs only) which are more accessible in practice. Theoretical justifications are provided for each module of MH-AIRL, and evaluations on challenging multi-task settings demonstrate superior performance and transferability of the multi-task policies learned with MH-AIRL as compared to SOTA MIL baselines.  ( 2 min )

In this work, we propose a novel framework for estimating the dimension of the data manifold using a trained diffusion model. A diffusion model approximates the score function i.e. the gradient of the log density of a noise-corrupted version of the target distribution for varying levels of corruption. If the data concentrates around a manifold embedded in the high-dimensional ambient space, then as the level of corruption decreases, the score function points towards the manifold, as this direction becomes the direction of maximal likelihood increase. Therefore, for small levels of corruption, the diffusion model provides us with access to an approximation of the normal bundle of the data manifold. This allows us to estimate the dimension of the tangent space, thus, the intrinsic dimension of the data manifold. To the best of our knowledge, our method is the first deep-learning based estimator of the data manifold dimension and it outperforms well established statistical estimators in controlled experiments on both Euclidean and image data.  ( 2 min )

Gross domestic product (GDP) is the most widely used indicator in macroeconomics and the main tool for measuring a country's economic ouput. Due to the diversity and complexity of the world economy, a wide range of models have been used, but there are challenges in making decadal GDP forecasts given unexpected changes such as pandemics and wars. Deep learning models are well suited for modeling temporal sequences have been applied for time series forecasting. In this paper, we develop a deep learning framework to forecast the GDP growth rate of the world economy over a decade. We use Penn World Table as the source of our data, taking data from 1980 to 2019, across 13 countries, such as Australia, China, India, the United States and so on. We test multiple deep learning models, LSTM, BD-LSTM, ED-LSTM and CNN, and compared their results with the traditional time series model (ARIMA,VAR). Our results indicate that ED-LSTM is the best performing model. We present a recursive deep learning framework to predict the GDP growth rate in the next ten years. We predict that most countries will experience economic growth slowdown, stagnation or even recession within five years; only China, France and India are predicted to experience stable, or increasing, GDP growth.  ( 2 min )

Approximately 1.2% of the world's population has impaired voice production. As a result, automatic dysphonic voice detection has attracted considerable academic and clinical interest. However, existing methods for automated voice assessment often fail to generalize outside the training conditions or to other related applications. In this paper, we propose a deep learning framework for generating acoustic feature embeddings sensitive to vocal quality and robust across different corpora. A contrastive loss is combined with a classification loss to train our deep learning model jointly. Data warping methods are used on input voice samples to improve the robustness of our method. Empirical results demonstrate that our method not only achieves high in-corpus and cross-corpus classification accuracy but also generates good embeddings sensitive to voice quality and robust across different corpora. We also compare our results against three baseline methods on clean and three variations of deteriorated in-corpus and cross-corpus datasets and demonstrate that the proposed model consistently outperforms the baseline methods.  ( 2 min )

Social media platforms struggle to protect users from harmful content through content moderation. These platforms have recently leveraged machine learning models to cope with the vast amount of user-generated content daily. Since moderation policies vary depending on countries and types of products, it is common to train and deploy the models per policy. However, this approach is highly inefficient, especially when the policies change, requiring dataset re-labeling and model re-training on the shifted data distribution. To alleviate this cost inefficiency, social media platforms often employ third-party content moderation services that provide prediction scores of multiple subtasks, such as predicting the existence of underage personnel, rude gestures, or weapons, instead of directly providing final moderation decisions. However, making a reliable automated moderation decision from the prediction scores of the multiple subtasks for a specific target policy has not been widely explored yet. In this study, we formulate real-world scenarios of content moderation and introduce a simple yet effective threshold optimization method that searches the optimal thresholds of the multiple subtasks to make a reliable moderation decision in a cost-effective way. Extensive experiments demonstrate that our approach shows better performance in content moderation compared to existing threshold optimization methods and heuristics.  ( 2 min )

In this paper, we consider the problem of iterative machine teaching, where a teacher provides examples sequentially based on the current iterative learner. In contrast to previous methods that have to scan over the entire pool and select teaching examples from it in each iteration, we propose a label synthesis teaching framework where the teacher randomly selects input teaching examples (e.g., images) and then synthesizes suitable outputs (e.g., labels) for them. We show that this framework can avoid costly example selection while still provably achieving exponential teachability. We propose multiple novel teaching algorithms in this framework. Finally, we empirically demonstrate the value of our framework.  ( 2 min )

We propose the Vision-and-Augmented-Language Transformer (VAuLT). VAuLT is an extension of the popular Vision-and-Language Transformer (ViLT), and improves performance on vision-and-language (VL) tasks that involve more complex text inputs than image captions while having minimal impact on training and inference efficiency. ViLT, importantly, enables efficient training and inference in VL tasks, achieved by encoding images using a linear projection of patches instead of an object detector. However, it is pretrained on captioning datasets, where the language input is simple, literal, and descriptive, therefore lacking linguistic diversity. So, when working with multimedia data in the wild, such as multimodal social media data, there is a notable shift from captioning language data, as well as diversity of tasks. We indeed find evidence that the language capacity of ViLT is lacking. The key insight and novelty of VAuLT is to propagate the output representations of a large language model (LM) like BERT to the language input of ViLT. We show that joint training of the LM and ViLT can yield relative improvements up to 20% over ViLT and achieve state-of-the-art or comparable performance on VL tasks involving richer language inputs and affective constructs, such as for Target-Oriented Sentiment Classification in TWITTER-2015 and TWITTER-2017, and Sentiment Classification in MVSA-Single and MVSA-Multiple. Our code is available at https://github.com/gchochla/VAuLT.  ( 2 min )

We investigate properties of goodness-of-fit tests based on the Kernel Stein Discrepancy (KSD). We introduce a strategy to construct a test, called KSDAgg, which aggregates multiple tests with different kernels. KSDAgg avoids splitting the data to perform kernel selection (which leads to a loss in test power), and rather maximises the test power over a collection of kernels. We provide non-asymptotic guarantees on the power of KSDAgg: we show it achieves the smallest uniform separation rate of the collection, up to a logarithmic term. For compactly supported densities with bounded model score function, we derive the rate for KSDAgg over restricted Sobolev balls; this rate corresponds to the minimax optimal rate over unrestricted Sobolev balls, up to an iterated logarithmic term. KSDAgg can be computed exactly in practice as it relies either on a parametric bootstrap or on a wild bootstrap to estimate the quantiles and the level corrections. In particular, for the crucial choice of bandwidth of a fixed kernel, it avoids resorting to arbitrary heuristics (such as median or standard deviation) or to data splitting. We find on both synthetic and real-world data that KSDAgg outperforms other state-of-the-art quadratic-time adaptive KSD-based goodness-of-fit testing procedures.  ( 2 min )

Influence function, a method from robust statistics, measures the changes of model parameters or some functions about model parameters concerning the removal or modification of training instances. It is an efficient and useful post-hoc method for studying the interpretability of machine learning models without the need for expensive model re-training. Recently, graph convolution networks (GCNs), which operate on graph data, have attracted a great deal of attention. However, there is no preceding research on the influence functions of GCNs to shed light on the effects of removing training nodes/edges from an input graph. Since the nodes/edges in a graph are interdependent in GCNs, it is challenging to derive influence functions for GCNs. To fill this gap, we started with the simple graph convolution (SGC) model that operates on an attributed graph and formulated an influence function to approximate the changes in model parameters when a node or an edge is removed from an attributed graph. Moreover, we theoretically analyzed the error bound of the estimated influence of removing an edge. We experimentally validated the accuracy and effectiveness of our influence estimation function. In addition, we showed that the influence function of an SGC model could be used to estimate the impact of removing training nodes/edges on the test performance of the SGC without re-training the model. Finally, we demonstrated how to use influence functions to guide the adversarial attacks on GCNs effectively.  ( 2 min )

Language models show a surprising range of capabilities, but the source of their apparent competence is unclear. Do these networks just memorize a collection of surface statistics, or do they rely on internal representations of the process that generates the sequences they see? We investigate this question by applying a variant of the GPT model to the task of predicting legal moves in a simple board game, Othello. Although the network has no a priori knowledge of the game or its rules, we uncover evidence of an emergent nonlinear internal representation of the board state. Interventional experiments indicate this representation can be used to control the output of the network and create "latent saliency maps" that can help explain predictions in human terms.  ( 2 min )

Natural language processing (NLP) is an area of artificial intelligence that applies information technologies to process the human language, understand it to a certain degree, and use it in various applications. This area has rapidly developed in the last few years and now employs modern variants of deep neural networks to extract relevant patterns from large text corpora. The main objective of this work is to survey the recent use of NLP in the field of pharmacology. As our work shows, NLP is a highly relevant information extraction and processing approach for pharmacology. It has been used extensively, from intelligent searches through thousands of medical documents to finding traces of adversarial drug interactions in social media. We split our coverage into five categories to survey modern NLP methodology, commonly addressed tasks, relevant textual data, knowledge bases, and useful programming libraries. We split each of the five categories into appropriate subcategories, describe their main properties and ideas, and summarize them in a tabular form. The resulting survey presents a comprehensive overview of the area, useful to practitioners and interested observers.  ( 2 min )

We propose Cut-and-LEaRn (CutLER), a simple approach for training unsupervised object detection and segmentation models. We leverage the property of self-supervised models to 'discover' objects without supervision and amplify it to train a state-of-the-art localization model without any human labels. CutLER first uses our proposed MaskCut approach to generate coarse masks for multiple objects in an image and then learns a detector on these masks using our robust loss function. We further improve the performance by self-training the model on its predictions. Compared to prior work, CutLER is simpler, compatible with different detection architectures, and detects multiple objects. CutLER is also a zero-shot unsupervised detector and improves detection performance AP50 by over 2.7 times on 11 benchmarks across domains like video frames, paintings, sketches, etc. With finetuning, CutLER serves as a low-shot detector surpassing MoCo-v2 by 7.3% APbox and 6.6% APmask on COCO when training with 5% labels.  ( 2 min )

The problem of piecewise affine (PWA) regression and planning is of foundational importance to the study of online learning, control, and robotics, where it provides a theoretically and empirically tractable setting to study systems undergoing sharp changes in the dynamics. Unfortunately, due to the discontinuities that arise when crossing into different ``pieces,'' learning in general sequential settings is impossible and practical algorithms are forced to resort to heuristic approaches. This paper builds on the recently developed smoothed online learning framework and provides the first algorithms for prediction and simulation in PWA systems whose regret is polynomial in all relevant problem parameters under a weak smoothness assumption; moreover, our algorithms are efficient in the number of calls to an optimization oracle. We further apply our results to the problems of one-step prediction and multi-step simulation regret in piecewise affine dynamical systems, where the learner is tasked with simulating trajectories and regret is measured in terms of the Wasserstein distance between simulated and true data. Along the way, we develop several technical tools of more general interest.  ( 2 min )

We consider the problem of performing Bayesian inference in probabilistic models where observations are accompanied by uncertainty, referred to as "uncertain evidence." We explore how to interpret uncertain evidence, and by extension the importance of proper interpretation as it pertains to inference about latent variables. We consider a recently-proposed method "distributional evidence" as well as revisit two older methods: Jeffrey's rule and virtual evidence. We devise guidelines on how to account for uncertain evidence and we provide new insights, particularly regarding consistency. To showcase the impact of different interpretations of the same uncertain evidence, we carry out experiments in which one interpretation is defined as "correct." We then compare inference results from each different interpretation illustrating the importance of careful consideration of uncertain evidence.  ( 2 min )

Interpreting machine learning models is challenging but crucial for ensuring the safety of deep networks in autonomous driving systems. Due to the prevalence of deep learning based perception models in autonomous vehicles, accurately interpreting their predictions is crucial. While a variety of such methods have been proposed, most are shown to lack robustness. Yet, little has been done to provide certificates for interpretability robustness. Taking a step in this direction, we present CORGI, short for Certifiably prOvable Robustness Guarantees for Interpretability mapping. CORGI is an algorithm that takes in an input image and gives a certifiable lower bound for the robustness of the top k pixels of its CAM interpretability map. We show the effectiveness of CORGI via a case study on traffic sign data, certifying lower bounds on the minimum adversarial perturbation not far from (4-5x) state-of-the-art attack methods.  ( 2 min )

The study proposes a quote-driven predictive automated market maker (AMM) platform with on-chain custody and settlement functions, alongside off-chain predictive reinforcement learning capabilities to improve liquidity provision of real-world AMMs. The proposed AMM architecture is an augmentation to the Uniswap V3, a cryptocurrency AMM protocol, by utilizing a novel market equilibrium pricing for reduced divergence and slippage loss. Further, the proposed architecture involves a predictive AMM capability, utilizing a deep hybrid Long Short-Term Memory (LSTM) and Q-learning reinforcement learning framework that looks to improve market efficiency through better forecasts of liquidity concentration ranges, so liquidity starts moving to expected concentration ranges, prior to asset price movement, so that liquidity utilization is improved. The augmented protocol framework is expected have practical real-world implications, by (i) reducing divergence loss for liquidity providers, (ii) reducing slippage for crypto-asset traders, while (iii) improving capital efficiency for liquidity provision for the AMM protocol. To our best knowledge, there are no known protocol or literature that are proposing similar deep learning-augmented AMM that achieves similar capital efficiency and loss minimization objectives for practical real-world applications.  ( 2 min )

Training neural networks to perform different tasks is relevant across various disciplines beyond Machine Learning. In particular, Recurrent Neural Networks (RNNs) are of great interest to different scientific communities. Open-source frameworks dedicated to Machine Learning, such as Tensorflow [1] and Keras [2] have produced significant changes in the development of technologies that we currently use. One relevant problem that can be approached with them is how to build the models to study dynamical systems and the brain. Specifically, how to extract the relevant information to answer the scientific questions of interest. The purpose of the present work is to contribute to this aim by analyzing a temporal processing task, in this case, a 3-bit Flip Flop memory. The modelling procedure in every step is shown: from equations to the software development. The networks obtained were analyzed to describe the dynamics and to show different visualization and analysis tools. The code developed in this premier is also provided to be used for modelling other tasks or systems.  ( 2 min )

Learning accurate predictive models of real-world dynamic phenomena (e.g., climate, biological) remains a challenging task. One key issue is that the data generated by both natural and artificial processes often comprise time series that are irregularly sampled and/or contain missing observations. In this work, we propose the Neural Continuous-Discrete State Space Model (NCDSSM) for continuous-time modeling of time series through discrete-time observations. NCDSSM employs auxiliary variables to disentangle recognition from dynamics, thus requiring amortized inference only for the auxiliary variables. Leveraging techniques from continuous-discrete filtering theory, we demonstrate how to perform accurate Bayesian inference for the dynamic states. We propose three flexible parameterizations of the latent dynamics and an efficient training objective that marginalizes the dynamic states during inference. Empirical results on multiple benchmark datasets across various domains show improved imputation and forecasting performance of NCDSSM over existing models.  ( 2 min )

Off-policy learning from multistep returns is crucial for sample-efficient reinforcement learning, but counteracting off-policy bias without exacerbating variance is challenging. Classically, off-policy bias is corrected in a per-decision manner: past temporal-difference errors are re-weighted by the instantaneous Importance Sampling (IS) ratio after each action via eligibility traces. Many off-policy algorithms rely on this mechanism, along with differing protocols for cutting the IS ratios to combat the variance of the IS estimator. Unfortunately, once a trace has been fully cut, the effect cannot be reversed. This has led to the development of credit-assignment strategies that account for multiple past experiences at a time. These trajectory-aware methods have not been extensively analyzed, and their theoretical justification remains uncertain. In this paper, we propose a multistep operator that can express both per-decision and trajectory-aware methods. We prove convergence conditions for our operator in the tabular setting, establishing the first guarantees for several existing methods as well as many new ones. Finally, we introduce Recency-Bounded Importance Sampling (RBIS), which leverages trajectory awareness to perform robustly across $\lambda$-values in an off-policy control task.  ( 2 min )

Affine image registration is a cornerstone of medical-image processing and analysis. While classical algorithms can achieve excellent accuracy, they solve a time-consuming optimization for every new image pair. Deep-learning (DL) methods learn a function that maps an image pair to an output transform. Evaluating the functions is fast, but capturing large transforms can be challenging, and networks tend to struggle if a test-image characteristic shifts from the training domain, such as the contrast or resolution. A majority of affine methods are also agnostic to the anatomy the user wishes to align; the registration will be inaccurate if algorithms consider all structures in the image. We address these shortcomings with a fast, robust, and easy-to-use DL tool for affine and deformable registration of any brain image without preprocessing, right off the MRI scanner. First, we rigorously analyze how competing architectures learn affine transforms across a diverse set of neuroimaging data, aiming to truly capture the behavior of methods in the real world. Second, we leverage a recent strategy to train networks with wildly varying images synthesized from label maps, yielding robust performance across acquisition specifics. Third, we optimize the spatial overlap of select anatomical labels, which enables networks to distinguish between anatomy of interest and irrelevant structures, removing the need for preprocessing that excludes content that would otherwise reduce the accuracy of anatomy-specific registration. We combine the affine model with prior work on deformable registration and test brain-specific registration across a landscape of MRI protocols unseen at training, demonstrating consistent and improved accuracy compared to existing tools. We distribute our code and tool at https://w3id.org/synthmorph, providing a single complete end-to-end solution for registration of brain MRI.  ( 3 min )

In recent years, particle-based variational inference (ParVI) methods such as Stein variational gradient descent (SVGD) have grown in popularity as scalable methods for Bayesian inference. Unfortunately, the properties of such methods invariably depend on hyperparameters such as the learning rate, which must be carefully tuned by the practitioner in order to ensure convergence to the target measure at a suitable rate. In this paper, we introduce a suite of new particle-based methods for scalable Bayesian inference based on coin betting, which are entirely learning-rate free. We illustrate the performance of our approach on a range of numerical examples, including several high-dimensional models and datasets, demonstrating comparable performance to other ParVI algorithms.  ( 2 min )

Neural Architecture Search (NAS) is widely used to automatically design the neural network with the best performance among a large number of candidate architectures. To reduce the search time, zero-shot NAS aims at designing training-free proxies that can predict the test performance of a given architecture. However, as shown recently, none of the zero-shot proxies proposed to date can actually work consistently better than a naive proxy, namely, the number of network parameters (#Params). To improve this state of affairs, as the main theoretical contribution, we first reveal how some specific gradient properties across different samples impact the convergence rate and generalization capacity of neural networks. Based on this theoretical analysis, we propose a new zero-shot proxy, ZiCo, the first proxy that works consistently better than #Params. We demonstrate that ZiCo works better than State-Of-The-Art (SOTA) proxies on several popular NAS-Benchmarks (NASBench101, NATSBench-SSS/TSS, TransNASBench-101) for multiple applications (e.g., image classification/reconstruction and pixel-level prediction). Finally, we demonstrate that the optimal architectures found via ZiCo are as competitive as the ones found by one-shot and multi-shot NAS methods, but with much less search time. For example, ZiCo-based NAS can find optimal architectures with 78.1%, 79.4%, and 80.4% test accuracy under inference budgets of 450M, 600M, and 1000M FLOPs on ImageNet within 0.4 GPU days.  ( 2 min )

This work formulates the machine learning mechanism as a bi-level optimization problem. The inner level optimization loop entails minimizing a properly chosen loss function evaluated on the training data. This is nothing but the well-studied training process in pursuit of optimal model parameters. The outer level optimization loop is less well-studied and involves maximizing a properly chosen performance metric evaluated on the validation data. This is what we call the "iteration process", pursuing optimal model hyper-parameters. Among many other degrees of freedom, this process entails model engineering (e.g., neural network architecture design) and management, experiment tracking, dataset versioning and augmentation. The iteration process could be automated via Automatic Machine Learning (AutoML) or left to the intuitions of machine learning students, engineers, and researchers. Regardless of the route we take, there is a need to reduce the computational cost of the iteration step and as a direct consequence reduce the carbon footprint of developing artificial intelligence algorithms. Despite the clean and unified mathematical formulation of the iteration step as a bi-level optimization problem, its solutions are case specific and complex. This work will consider such cases while increasing the level of complexity from supervised learning to semi-supervised, self-supervised, unsupervised, few-shot, federated, reinforcement, and physics-informed learning. As a consequence of this exercise, this proposal surfaces a plethora of open problems in the field, many of which can be addressed in parallel.  ( 2 min )

Recent developments using End-to-End Deep Learning models have been shown to have near or better performance than state of the art Recurrent Neural Networks (RNNs) on Automatic Speech Recognition tasks. These models tend to be lighter weight and require less training time than traditional RNN-based approaches. However, these models take frequentist approach to weight training. In theory, network weights are drawn from a latent, intractable probability distribution. We introduce BayesSpeech for end-to-end Automatic Speech Recognition. BayesSpeech is a Bayesian Transformer Network where these intractable posteriors are learned through variational inference and the local reparameterization trick without recurrence. We show how the introduction of variance in the weights leads to faster training time and near state-of-the-art performance on LibriSpeech-960.  ( 2 min )

We provide a theoretical framework for Reinforcement Learning with Human Feedback (RLHF). Our analysis shows that when the true reward function is linear, the widely used maximum likelihood estimator (MLE) converges under both the Bradley-Terry-Luce (BTL) model and the Plackett-Luce (PL) model. However, we show that when training a policy based on the learned reward model, MLE fails while a pessimistic MLE provides policies with improved performance under certain coverage assumptions. Additionally, we demonstrate that under the PL model, the true MLE and an alternative MLE that splits the $K$-wise comparison into pairwise comparisons both converge. Moreover, the true MLE is asymptotically more efficient. Our results validate the empirical success of existing RLHF algorithms in InstructGPT and provide new insights for algorithm design. Furthermore, our results unify the problem of RLHF and Max Entropy Inverse Reinforcement Learning, and provide the first sample complexity bound for both problems.  ( 2 min )

In this paper we propose a novel and computationally efficient method to simultaneously achieve vertex embedding, community detection, and community size determination. By utilizing a normalized one-hot graph encoder and a new rank-based cluster size measure, the proposed graph encoder ensemble algorithm achieves excellent numerical performance throughout a variety of simulations and real data experiments.  ( 2 min )

Language models (LMs) pretrained on large corpora of text from the web have been observed to contain large amounts of various types of knowledge about the world. This observation has led to a new and exciting paradigm in knowledge graph construction where, instead of manual curation or text mining, one extracts knowledge from the parameters of an LM. Recently, it has been shown that finetuning LMs on a set of factual knowledge makes them produce better answers to queries from a different set, thus making finetuned LMs a good candidate for knowledge extraction and, consequently, knowledge graph construction. In this paper, we analyze finetuned LMs for factual knowledge extraction. We show that along with its previously known positive effects, finetuning also leads to a (potentially harmful) phenomenon which we call Frequency Shock, where at the test time the model over-predicts rare entities that appear in the training set and under-predicts common entities that do not appear in the training set enough times. We show that Frequency Shock leads to a degradation in the predictions of the model and beyond a point, the harm from Frequency Shock can even outweigh the positive effects of finetuning, making finetuning harmful overall. We then consider two solutions to remedy the identified negative effect: 1- model mixing and 2- mixture finetuning with the LM's pre-training task. The two solutions combined lead to significant improvements compared to vanilla finetuning.  ( 2 min )

We present MAV3D (Make-A-Video3D), a method for generating three-dimensional dynamic scenes from text descriptions. Our approach uses a 4D dynamic Neural Radiance Field (NeRF), which is optimized for scene appearance, density, and motion consistency by querying a Text-to-Video (T2V) diffusion-based model. The dynamic video output generated from the provided text can be viewed from any camera location and angle, and can be composited into any 3D environment. MAV3D does not require any 3D or 4D data and the T2V model is trained only on Text-Image pairs and unlabeled videos. We demonstrate the effectiveness of our approach using comprehensive quantitative and qualitative experiments and show an improvement over previously established internal baselines. To the best of our knowledge, our method is the first to generate 3D dynamic scenes given a text description.  ( 2 min )

Due to the advent of the expressions of data other than tabular formats, the topological compositions which make samples interrelated came into prominence. Analogically, those networks can be interpreted as social connections, dataflow maps, citation influence graphs, protein bindings, etc. However, in the case of social networks, it is highly crucial to evaluate the labels of discrete communities. The reason underneath for such a study is the non-negligible importance of analyzing graph networks to partition the vertices by using the topological features of network graphs, solely. For each of these interaction-based entities, a social graph, a mailing dataset, and two citation sets are selected as the testbench repositories. This paper, it was not only assessed the most valuable method but also determined how graph neural networks work and the need to improve against non-neural network approaches which are faster and computationally cost-effective. Also, this paper showed a limit to be excesses by prospective graph neural network variations by using the topological features of networks trialed.  ( 2 min )

We present a model inversion algorithm, CKLEMAP, for data assimilation and parameter estimation in partial differential equation models of physical systems with spatially heterogeneous parameter fields. These fields are approximated using low-dimensional conditional Karhunen-Lo\'{e}ve expansions, which are constructed using Gaussian process regression models of these fields trained on the parameters' measurements. We then assimilate measurements of the state of the system and compute the maximum a posteriori estimate of the CKLE coefficients by solving a nonlinear least-squares problem. When solving this optimization problem, we efficiently compute the Jacobian of the vector objective by exploiting the sparsity structure of the linear system of equations associated with the forward solution of the physics problem. The CKLEMAP method provides better scalability compared to the standard MAP method. In the MAP method, the number of unknowns to be estimated is equal to the number of elements in the numerical forward model. On the other hand, in CKLEMAP, the number of unknowns (CKLE coefficients) is controlled by the smoothness of the parameter field and the number of measurements, and is in general much smaller than the number of discretization nodes, which leads to a significant reduction of computational cost with respect to the standard MAP method. To show its advantage in scalability, we apply CKLEMAP to estimate the transmissivity field in a two-dimensional steady-state subsurface flow model of the Hanford Site by assimilating synthetic measurements of transmissivity and hydraulic head. We find that the execution time of CKLEMAP scales nearly linearly as $N^{1.33}$, where $N$ is the number of discretization nodes, while the execution time of standard MAP scales as $N^{2.91}$. The CKLEMAP method improved execution time without sacrificing accuracy when compared to the standard MAP.  ( 3 min )

This article presents a vision where \textit{real-time} digital twins of the physical wireless environments are continuously updated using multi-modal sensing data from the distributed infrastructure and user devices, and are used to make communication and sensing decisions. This vision is mainly enabled by the advances in precise 3D maps, multi-modal sensing, ray-tracing computations, and machine/deep learning. This article details this vision, explains the different approaches for constructing and utilizing these real-time digital twins, discusses the applications and open problems, and presents a research platform that can be used to investigate various digital twin research directions.  ( 2 min )

This paper studies online convex optimization with stochastic constraints. We propose a variant of the drift-plus-penalty algorithm that guarantees $O(\sqrt{T})$ expected regret and zero constraint violation, after a fixed number of iterations, which improves the vanilla drift-plus-penalty method with $O(\sqrt{T})$ constraint violation. Our algorithm is oblivious to the length of the time horizon $T$, in contrast to the vanilla drift-plus-penalty method. This is based on our novel drift lemma that provides time-varying bounds on the virtual queue drift and, as a result, leads to time-varying bounds on the expected virtual queue length. Moreover, we extend our framework to stochastic-constrained online convex optimization under two-point bandit feedback. We show that by adapting our algorithmic framework to the bandit feedback setting, we may still achieve $O(\sqrt{T})$ expected regret and zero constraint violation, improving upon the previous work for the case of identical constraint functions. Numerical results demonstrate our theoretical results.  ( 2 min )

It is challenging for generative models to learn a distribution over graphs because of the lack of permutation invariance: nodes may be ordered arbitrarily across graphs, and standard graph alignment is combinatorial and notoriously expensive. We propose AlignGraph, a group of generative models that combine fast and efficient graph alignment methods with a family of deep generative models that are invariant to node permutations. Our experiments demonstrate that our framework successfully learns graph distributions, outperforming competitors by 25% -560% in relevant performance scores.  ( 2 min )

In this paper, we study the predict-then-optimize problem where the output of a machine learning prediction task is used as the input of some downstream optimization problem, say, the objective coefficient vector of a linear program. The problem is also known as predictive analytics or contextual linear programming. The existing approaches largely suffer from either (i) optimization intractability (a non-convex objective function)/statistical inefficiency (a suboptimal generalization bound) or (ii) requiring strong condition(s) such as no constraint or loss calibration. We develop a new approach to the problem called \textit{maximum optimality margin} which designs the machine learning loss function by the optimality condition of the downstream optimization. The max-margin formulation enjoys both computational efficiency and good theoretical properties for the learning procedure. More importantly, our new approach only needs the observations of the optimal solution in the training data rather than the objective function, which makes it a new and natural approach to the inverse linear programming problem under both contextual and context-free settings; we also analyze the proposed method under both offline and online settings, and demonstrate its performance using numerical experiments.  ( 2 min )

Machine learning and deep learning play vital roles in predicting diseases in the medical field. Machine learning algorithms are widely classified as supervised, unsupervised, and reinforcement learning. This paper contains a detailed description of our experimental research work in that we used a supervised machine-learning algorithm to build our model for outbreaks of the novel Coronavirus that has spread over the whole world and caused many deaths, which is one of the most disastrous Pandemics in the history of the world. The people suffered physically and economically to survive in this lockdown. This work aims to understand better how machine learning, ensemble, and deep learning models work and are implemented in the real dataset. In our work, we are going to analyze the current trend or pattern of the coronavirus and then predict the further future of the covid-19 confirmed cases or new cases by training the past Covid-19 dataset by using the machine learning algorithm such as Linear Regression, Polynomial Regression, K-nearest neighbor, Decision Tree, Support Vector Machine and Random forest algorithm are used to train the model. The decision tree and the Random Forest algorithm perform better than SVR in this work. The performance of SVR and lasso regression are low in all prediction areas Because the SVR is challenging to separate the data using the hyperplane for this type of problem. So SVR mostly gives a lower performance in this problem. Ensemble (Voting, Bagging, and Stacking) and deep learning models(ANN) also predict well. After the prediction, we evaluated the model using MAE, MSE, RMSE, and MAPE. This work aims to find the trend/pattern of the covid-19.  ( 3 min )

Molecule generation with desired properties has grown immensely in popularity by disruptively changing the way scientists design molecular structures and providing support for chemical and materials design. However, despite the promising outcome, previous machine learning-based deep generative models suffer from a reliance on complex, task-specific fine-tuning, limited dimensional latent spaces, or the quality of expert rules. In this work, we propose MolGen, a pre-trained molecular language model that effectively learns and shares knowledge across multiple generation tasks and domains. Specifically, we pre-train MolGen with the chemical language SELFIES on more than 100 million unlabelled molecules. We further propose multi-task molecular prefix tuning across several molecular generation tasks and different molecular domains (synthetic & natural products) with a self-feedback mechanism. Extensive experiments show that MolGen can obtain superior performances on well-known molecular generation benchmark datasets. The further analysis illustrates that MolGen can accurately capture the distribution of molecules, implicitly learn their structural characteristics, and efficiently explore the chemical space with the guidance of multi-task molecular prefix tuning. Codes, datasets, and the pre-trained model will be available in https://github.com/zjunlp/MolGen.  ( 2 min )

Network binarization emerges as one of the most promising compression approaches offering extraordinary computation and memory savings by minimizing the bit-width. However, recent research has shown that applying existing binarization algorithms to diverse tasks, architectures, and hardware in realistic scenarios is still not straightforward. Common challenges of binarization, such as accuracy degradation and efficiency limitation, suggest that its attributes are not fully understood. To close this gap, we present BiBench, a rigorously designed benchmark with in-depth analysis for network binarization. We first carefully scrutinize the requirements of binarization in the actual production and define evaluation tracks and metrics for a comprehensive and fair investigation. Then, we evaluate and analyze a series of milestone binarization algorithms that function at the operator level and with extensive influence. Our benchmark reveals that 1) the binarized operator has a crucial impact on the performance and deployability of binarized networks; 2) the accuracy of binarization varies significantly across different learning tasks and neural architectures; 3) binarization has demonstrated promising efficiency potential on edge devices despite the limited hardware support. The results and analysis also lead to a promising paradigm for accurate and efficient binarization. We believe that BiBench will contribute to the broader adoption of binarization and serve as a foundation for future research.  ( 2 min )

We present a novel data-efficient semi-supervised framework to improve the generalization of image captioning models. Constructing a large-scale labeled image captioning dataset is an expensive task in terms of labor, time, and cost. In contrast to manually annotating all the training samples, separately collecting uni-modal datasets is immensely easier, e.g., a large-scale image dataset and a sentence dataset. We leverage such massive unpaired image and caption data upon standard paired data by learning to associate them. To this end, our proposed semi-supervised learning method assigns pseudo-labels to unpaired samples in an adversarial learning fashion, where the joint distribution of image and caption is learned. Our method trains a captioner to learn from a paired data and to progressively associate unpaired data. This approach shows noticeable performance improvement even in challenging scenarios including out-of-task data (i.e., relational captioning, where the target task is different from the unpaired data) and web-crawled data. We also show that our proposed method is theoretically well-motivated and has a favorable global optimal property. Our extensive and comprehensive empirical results both on (1) image-based and (2) dense region-based captioning datasets followed by comprehensive analysis on the scarcely-paired COCO dataset demonstrate the consistent effectiveness of our semisupervised learning method with unpaired data compared to competing methods.  ( 2 min )

We present a generalized linear structural causal model, coupled with a novel data-adaptive linear regularization, to recover causal directed acyclic graphs (DAGs) from time series. By leveraging a recently developed stochastic monotone Variational Inequality (VI) formulation, we cast the causal discovery problem as a general convex optimization. Furthermore, we develop a non-asymptotic recovery guarantee and quantifiable uncertainty by solving a linear program to establish confidence intervals for a wide range of non-linear monotone link functions. We validate our theoretical results and show the competitive performance of our method via extensive numerical experiments. Most importantly, we demonstrate the effectiveness of our approach in recovering highly interpretable causal DAGs over Sepsis Associated Derangements (SADs) while achieving comparable prediction performance to powerful ``black-box'' models such as XGBoost. Thus, the future adoption of our proposed method to conduct continuous surveillance of high-risk patients by clinicians is much more likely.  ( 2 min )

A directed acyclic graph (DAG) provides valuable prior knowledge that is often discarded in regression tasks in machine learning. We show that the independences arising from the presence of collider structures in DAGs provide meaningful inductive biases, which constrain the regression hypothesis space and improve predictive performance. We introduce collider regression, a framework to incorporate probabilistic causal knowledge from a collider in a regression problem. When the hypothesis space is a reproducing kernel Hilbert space, we prove a strictly positive generalisation benefit under mild assumptions and provide closed-form estimators of the empirical risk minimiser. Experiments on synthetic and climate model data demonstrate performance gains of the proposed methodology.  ( 2 min )

Graph neural networks have received increased attention over the past years due to their promising ability to handle graph-structured data, which can be found in many real-world problems such as recommended systems and drug synthesis. Most existing research focuses on using graph neural networks to solve homophilous problems, but little attention has been paid to heterophily-type problems. In this paper, we propose a graph network model for graph coloring, which is a class of representative heterophilous problems. Different from the conventional graph networks, we introduce negative message passing into the proposed graph neural network for more effective information exchange in handling graph coloring problems. Moreover, a new loss function taking into account the self-information of the nodes is suggested to accelerate the learning process. Experimental studies are carried out to compare the proposed graph model with five state-of-the-art algorithms on ten publicly available graph coloring problems and one real-world application. Numerical results demonstrate the effectiveness of the proposed graph neural network.  ( 2 min )

Selecting exploratory actions that generate a rich stream of experience for better learning is a fundamental challenge in reinforcement learning (RL). An approach to tackle this problem consists in selecting actions according to specific policies for an extended period of time, also known as options. A recent line of work to derive such exploratory options builds upon the eigenfunctions of the graph Laplacian. Importantly, until now these methods have been mostly limited to tabular domains where (1) the graph Laplacian matrix was either given or could be fully estimated, (2) performing eigendecomposition on this matrix was computationally tractable, and (3) value functions could be learned exactly. Additionally, these methods required a separate option discovery phase. These assumptions are fundamentally not scalable. In this paper we address these limitations and show how recent results for directly approximating the eigenfunctions of the Laplacian can be leveraged to truly scale up options-based exploration. To do so, we introduce a fully online deep RL algorithm for discovering Laplacian-based options and evaluate our approach on a variety of pixel-based tasks. We compare to several state-of-the-art exploration methods and show that our approach is effective, general, and especially promising in non-stationary settings.  ( 2 min )

Flexible duplex networks allow users to dynamically employ uplink and downlink channels without static time scheduling, thereby utilizing the network resources efficiently. This work investigates the sum-rate maximization of flexible duplex networks. In particular, we consider a network with pairwise-fixed communication links. Corresponding combinatorial optimization is a non-deterministic polynomial (NP)-hard without a closed-form solution. In this respect, the existing heuristics entail high computational complexity, raising a scalability issue in large networks. Motivated by the recent success of Graph Neural Networks (GNNs) in solving NP-hard wireless resource management problems, we propose a novel GNN architecture, named Flex-Net, to jointly optimize the communication direction and transmission power. The proposed GNN produces near-optimal performance meanwhile maintaining a low computational complexity compared to the most commonly used techniques. Furthermore, our numerical results shed light on the advantages of using GNNs in terms of sample complexity, scalability, and generalization capability.  ( 2 min )

A major challenge of reinforcement learning (RL) in real-world applications is the variation between environments, tasks or clients. Meta-RL (MRL) addresses this issue by learning a meta-policy that adapts to new tasks. Standard MRL methods optimize the average return over tasks, but often suffer from poor results in tasks of high risk or difficulty. This limits system reliability whenever test tasks are not known in advance. In this work, we propose a robust MRL objective with a controlled robustness level. Optimization of analogous robust objectives in RL often leads to both biased gradients and data inefficiency. We prove that the former disappears in MRL, and address the latter via the novel Robust Meta RL algorithm (RoML). RoML is a meta-algorithm that generates a robust version of any given MRL algorithm, by identifying and over-sampling harder tasks throughout training. We demonstrate that RoML learns substantially different meta-policies and achieves robust returns on several navigation and continuous control benchmarks.  ( 2 min )

In reinforcement learning (RL) with experience replay, experiences stored in a replay buffer influence the RL agent's performance. Information about the influence is valuable for various purposes, including experience cleansing and analysis. One method for estimating the influence of individual experiences is agent comparison, but it is prohibitively expensive when there is a large number of experiences. In this paper, we present PI+ToD as a method for efficiently estimating the influence of experiences. PI+ToD is a policy iteration that efficiently estimates the influence of experiences by utilizing turn-over dropout. We demonstrate the efficiency of PI+ToD with experiments in MuJoCo environments.  ( 2 min )

We propose a simplicial complex convolutional neural network (SCCNN) to learn data representations on simplicial complexes. It performs convolutions based on the multi-hop simplicial adjacencies via common faces and cofaces independently and captures the inter-simplicial couplings, generalizing state-of-the-art. Upon studying symmetries of the simplicial domain and the data space, it is shown to be permutation and orientation equivariant, thus, incorporating such inductive biases. Based on the Hodge theory, we perform a spectral analysis to understand how SCCNNs regulate data in different frequencies, showing that the convolutions via faces and cofaces operate in two orthogonal data spaces. Lastly, we study the stability of SCCNNs to domain deformations and examine the effects of various factors. Empirical results show the benefits of higher-order convolutions and inter-simplicial couplings in simplex prediction and trajectory prediction.  ( 2 min )

Currently, applying diffusion models in pixel space of high resolution images is difficult. Instead, existing approaches focus on diffusion in lower dimensional spaces (latent diffusion), or have multiple super-resolution levels of generation referred to as cascades. The downside is that these approaches add additional complexity to the diffusion framework. This paper aims to improve denoising diffusion for high resolution images while keeping the model as simple as possible. The paper is centered around the research question: How can one train a standard denoising diffusion models on high resolution images, and still obtain performance comparable to these alternate approaches? The four main findings are: 1) the noise schedule should be adjusted for high resolution images, 2) It is sufficient to scale only a particular part of the architecture, 3) dropout should be added at specific locations in the architecture, and 4) downsampling is an effective strategy to avoid high resolution feature maps. Combining these simple yet effective techniques, we achieve state-of-the-art on image generation among diffusion models without sampling modifiers on ImageNet.  ( 2 min )

Graphs are widely used to represent the relations among entities. When one owns the complete data, an entire graph can be easily built, therefore performing analysis on the graph is straightforward. However, in many scenarios, it is impractical to centralize the data due to data privacy concerns. An organization or party only keeps a part of the whole graph data, i.e., graph data is isolated from different parties. Recently, Federated Learning (FL) has been proposed to solve the data isolation issue, mainly for Euclidean data. It is still a challenge to apply FL on graph data because graphs contain topological information which is notorious for its non-IID nature and is hard to partition. In this work, we propose a novel FL framework for graph data, FedCog, to efficiently handle coupled graphs that are a kind of distributed graph data, but widely exist in a variety of real-world applications such as mobile carriers' communication networks and banks' transaction networks. We theoretically prove the correctness and security of FedCog. Experimental results demonstrate that our method FedCog significantly outperforms traditional FL methods on graphs. Remarkably, our FedCog improves the accuracy of node classification tasks by up to 14.7%.  ( 2 min )

Federated Reinforcement Learning (FedRL) encourages distributed agents to learn collectively from each other's experience to improve their performance without exchanging their raw trajectories. The existing work on FedRL assumes that all participating agents are homogeneous, which requires all agents to share the same policy parameterization (e.g., network architectures and training configurations). However, in real-world applications, agents are often in disagreement about the architecture and the parameters, possibly also because of disparate computational budgets. Because homogeneity is not given in practice, we introduce the problem setting of Federated Reinforcement Learning with Heterogeneous And bLack-box agEnts (FedRL-HALE). We present the unique challenges this new setting poses and propose the Federated Heterogeneous Q-Learning (FedHQL) algorithm that principally addresses these challenges. We empirically demonstrate the efficacy of FedHQL in boosting the sample efficiency of heterogeneous agents with distinct policy parameterization using standard RL tasks.  ( 2 min )

Multi-agent reinforcement learning typically suffers from the problem of sample inefficiency, where learning suitable policies involves the use of many data samples. Learning from external demonstrators is a possible solution that mitigates this problem. However, most prior approaches in this area assume the presence of a single demonstrator. Leveraging multiple knowledge sources (i.e., advisors) with expertise in distinct aspects of the environment could substantially speed up learning in complex environments. This paper considers the problem of simultaneously learning from multiple independent advisors in multi-agent reinforcement learning. The approach leverages a two-level Q-learning architecture, and extends this framework from single-agent to multi-agent settings. We provide principled algorithms that incorporate a set of advisors by both evaluating the advisors at each state and subsequently using the advisors to guide action selection. We also provide theoretical convergence and sample complexity guarantees. Experimentally, we validate our approach in three different test-beds and show that our algorithms give better performances than baselines, can effectively integrate the combined expertise of different advisors, and learn to ignore bad advice.  ( 2 min )

Consider the setting where a $\rho$-sparse Rademacher vector is planted in a random $d$-dimensional subspace of $R^n$. A classical question is how to recover this planted vector given a random basis in this subspace. A recent result by [ZSWB21] showed that the Lattice basis reduction algorithm can recover the planted vector when $n\geq d+1$. Although the algorithm is not expected to tolerate inverse polynomial amount of noise, it is surprising because it was previously shown that recovery cannot be achieved by low degree polynomials when $n\ll \rho^2 d^{2}$ [MW21]. A natural question is whether we can derive an Statistical Query (SQ) lower bound matching the previous low degree lower bound in [MW21]. This will - imply that the SQ lower bound can be surpassed by lattice based algorithms; - predict the computational hardness when the planted vector is perturbed by inverse polynomial amount of noise. In this paper, we prove such an SQ lower bound. In particular, we show that super-polynomial number of VSTAT queries is needed to solve the easier statistical testing problem when $n\ll \rho^2 d^{2}$ and $\rho\gg \frac{1}{\sqrt{d}}$. The most notable technique we used to derive the SQ lower bound is the almost equivalence relationship between SQ lower bound and low degree lower bound [BBH+20, MW21].  ( 2 min )

Mesoscale structures are an integral part of the abstraction and analysis of complex systems. They reveal a node's function in the network, and facilitate our understanding of the network dynamics. For example, they can represent communities in social or citation networks, roles in corporate interactions, or core-periphery structures in transportation networks. We usually detect mesoscale structures under the assumption of independence of interactions. Still, in many cases, the interactions invalidate this assumption by occurring in a specific order. Such patterns emerge in pathway data; to capture them, we have to model the dependencies between interactions using higher-order network models. However, the detection of mesoscale structures in higher-order networks is still under-researched. In this work, we derive a Bayesian approach that simultaneously models the optimal partitioning of nodes in groups and the optimal higher-order network dynamics between the groups. In synthetic data we demonstrate that our method can recover both standard proximity-based communities and role-based groupings of nodes. In synthetic and real world data we show that it can compete with baseline techniques, while additionally providing interpretable abstractions of network dynamics.  ( 2 min )

Ransomware is a rapidly evolving type of malware designed to encrypt user files on a device, making them inaccessible in order to exact a ransom. Ransomware attacks resulted in billions of dollars in damages in recent years and are expected to cause hundreds of billions more in the next decade. With current state-of-the-art process-based detectors being heavily susceptible to evasion attacks, no comprehensive solution to this problem is available today. This paper presents Minerva, a new approach to ransomware detection. Unlike current methods focused on identifying ransomware based on process-level behavioral modeling, Minerva detects ransomware by building behavioral profiles of files based on all the operations they receive in a time window. Minerva addresses some of the critical challenges associated with process-based approaches, specifically their vulnerability to complex evasion attacks. Our evaluation of Minerva demonstrates its effectiveness in detecting ransomware attacks, including those that are able to bypass existing defenses. Our results show that Minerva identifies ransomware activity with an average accuracy of 99.45% and an average recall of 99.66%, with 99.97% of ransomware detected within 1 second.  ( 2 min )

In this paper, we study how to achieve two characteristics highly-expected by incomplete multi-view clustering (IMvC). Namely, i) instance commonality refers to that within-cluster instances should share a common pattern, and ii) view versatility refers to that cross-view samples should own view-specific patterns. To this end, we design a novel dual-stream model which employs a dual attention layer and a dual contrastive learning loss to learn view-specific prototypes and model the sample-prototype relationship. When the view is missed, our model performs data recovery using the prototypes in the missing view and the sample-prototype relationship inherited from the observed view. Thanks to our dual-stream model, both cluster- and view-specific information could be captured, and thus the instance commonality and view versatility could be preserved to facilitate IMvC. Extensive experiments demonstrate the superiority of our method on six challenging benchmarks compared with 11 approaches. The code will be released.  ( 2 min )

We introduce a new class of spatially stochastic physics and data informed deep latent models for parametric partial differential equations (PDEs) which operate through scalable variational neural processes. We achieve this by assigning probability measures to the spatial domain, which allows us to treat collocation grids probabilistically as random variables to be marginalised out. Adapting this spatial statistics view, we solve forward and inverse problems for parametric PDEs in a way that leads to the construction of Gaussian process models of solution fields. The implementation of these random grids poses a unique set of challenges for inverse physics informed deep learning frameworks and we propose a new architecture called Grid Invariant Convolutional Networks (GICNets) to overcome these challenges. We further show how to incorporate noisy data in a principled manner into our physics informed model to improve predictions for problems where data may be available but whose measurement location does not coincide with any fixed mesh or grid. The proposed method is tested on a nonlinear Poisson problem, Burgers equation, and Navier-Stokes equations, and we provide extensive numerical comparisons. We demonstrate significant computational advantages over current physics informed neural learning methods for parametric PDEs while improving the predictive capabilities and flexibility of these models.  ( 2 min )

Most classification models treat all misclassifications equally. However, different classes may be related, and these hierarchical relationships must be considered in some classification problems. These problems can be addressed by using hierarchical information during training. Unfortunately, this information is not available for all datasets. Many classification-based metric learning methods use class representatives in embedding space to represent different classes. The relationships among the learned class representatives can then be used to estimate class hierarchical structures. If we have a predefined class hierarchy, the learned class representatives can be assessed to determine whether the metric learning model learned semantic distances that match our prior knowledge. In this work, we train a softmax classifier and three metric learning models with several training options on benchmark and real-world datasets. In addition to the standard classification accuracy, we evaluate the hierarchical inference performance by inspecting learned class representatives and the hierarchy-informed performance, i.e., the classification performance, and the metric learning performance by considering predefined hierarchical structures. Furthermore, we investigate how the considered measures are affected by various models and training options. When our proposed ProxyDR model is trained without using predefined hierarchical structures, the hierarchical inference performance is significantly better than that of the popular NormFace model. Additionally, our model enhances some hierarchy-informed performance measures under the same training options. We also found that convolutional neural networks (CNNs) with random weights correspond to the predefined hierarchies better than random chance.  ( 2 min )

The ability to accurately predict deep neural network (DNN) inference performance metrics, such as latency, power, and memory footprint, for an arbitrary DNN on a target hardware platform is essential to the design of DNN based models. This ability is critical for the (manual or automatic) design, optimization, and deployment of practical DNNs for a specific hardware deployment platform. Unfortunately, these metrics are slow to evaluate using simulators (where available) and typically require measurement on the target hardware. This work describes PerfSAGE, a novel graph neural network (GNN) that predicts inference latency, energy, and memory footprint on an arbitrary DNN TFlite graph (TFL, 2017). In contrast, previously published performance predictors can only predict latency and are restricted to pre-defined construction rules or search spaces. This paper also describes the EdgeDLPerf dataset of 134,912 DNNs randomly sampled from four task search spaces and annotated with inference performance metrics from three edge hardware platforms. Using this dataset, we train PerfSAGE and provide experimental results that demonstrate state-of-the-art prediction accuracy with a Mean Absolute Percentage Error of <5% across all targets and model search spaces. These results: (1) Outperform previous state-of-art GNN-based predictors (Dudziak et al., 2020), (2) Accurately predict performance on accelerators (a shortfall of non-GNN-based predictors (Zhang et al., 2021)), and (3) Demonstrate predictions on arbitrary input graphs without modifications to the feature extractor.  ( 2 min )

Recently, many works studied the expressive power of graph neural networks (GNNs) by linking it to the $1$-dimensional Weisfeiler--Leman algorithm ($1\text{-}\mathsf{WL}$). Here, the $1\text{-}\mathsf{WL}$ is a well-studied heuristic for the graph isomorphism problem, which iteratively colors or partitions a graph's vertex set. While this connection has led to significant advances in understanding and enhancing GNNs' expressive power, it does not provide insights into their generalization performance, i.e., their ability to make meaningful predictions beyond the training set. In this paper, we study GNNs' generalization ability through the lens of Vapnik--Chervonenkis (VC) dimension theory in two settings, focusing on graph-level predictions. First, when no upper bound on the graphs' order is known, we show that the bitlength of GNNs' weights tightly bounds their VC dimension. Further, we derive an upper bound for GNNs' VC dimension using the number of colors produced by the $1\text{-}\mathsf{WL}$. Secondly, when an upper bound on the graphs' order is known, we show a tight connection between the number of graphs distinguishable by the $1\text{-}\mathsf{WL}$ and GNNs' VC dimension. Our empirical study confirms the validity of our theoretical findings.  ( 2 min )

This work considers multiple agents traversing a network from a source node to the goal node. The cost to an agent for traveling a link has a private as well as a congestion component. The agent's objective is to find a path to the goal node with minimum overall cost in a decentralized way. We model this as a fully decentralized multi-agent reinforcement learning problem and propose a novel multi-agent congestion cost minimization (MACCM) algorithm. Our MACCM algorithm uses linear function approximations of transition probabilities and the global cost function. In the absence of a central controller and to preserve privacy, agents communicate the cost function parameters to their neighbors via a time-varying communication network. Moreover, each agent maintains its estimate of the global state-action value, which is updated via a multi-agent extended value iteration (MAEVI) sub-routine. We show that our MACCM algorithm achieves a sub-linear regret. The proof requires the convergence of cost function parameters, the MAEVI algorithm, and analysis of the regret bounds induced by the MAEVI triggering condition for each agent. We implement our algorithm on a two node network with multiple links to validate it. We first identify the optimal policy, the optimal number of agents going to the goal node in each period. We observe that the average regret is close to zero for 2 and 3 agents. The optimal policy captures the trade-off between the minimum cost of staying at a node and the congestion cost of going to the goal node. Our work is a generalization of learning the stochastic shortest path problem.  ( 2 min )

Real-time machine learning has recently attracted significant interest due to its potential to support instantaneous learning, adaptation, and decision making in a wide range of application domains, including self-driving vehicles, intelligent transportation, and industry automation. We investigate real-time ML in a federated edge intelligence (FEI) system, an edge computing system that implements federated learning (FL) solutions based on data samples collected and uploaded from decentralized data networks. FEI systems often exhibit heterogenous communication and computational resource distribution, as well as non-i.i.d. data samples, resulting in long model training time and inefficient resource utilization. Motivated by this fact, we propose a time-sensitive federated learning (TS-FL) framework to minimize the overall run-time for collaboratively training a shared ML model. Training acceleration solutions for both TS-FL with synchronous coordination (TS-FL-SC) and asynchronous coordination (TS-FL-ASC) are investigated. To address straggler effect in TS-FL-SC, we develop an analytical solution to characterize the impact of selecting different subsets of edge servers on the overall model training time. A server dropping-based solution is proposed to allow slow-performance edge servers to be removed from participating in model training if their impact on the resulting model accuracy is limited. A joint optimization algorithm is proposed to minimize the overall time consumption of model training by selecting participating edge servers, local epoch number. We develop an analytical expression to characterize the impact of staleness effect of asynchronous coordination and straggler effect of FL on the time consumption of TS-FL-ASC. Experimental results show that TS-FL-SC and TS-FL-ASC can provide up to 63% and 28% of reduction, in the overall model training time, respectively.  ( 2 min )

We consider stochastic unconstrained bilevel optimization problems when only the first-order gradient oracles are available. While numerous optimization methods have been proposed for tackling bilevel problems, existing methods either tend to require possibly expensive calculations regarding Hessians of lower-level objectives, or lack rigorous finite-time performance guarantees. In this work, we propose a Fully First-order Stochastic Approximation (F2SA) method, and study its non-asymptotic convergence properties. Specifically, we show that F2SA converges to an $\epsilon$-stationary solution of the bilevel problem after $\epsilon^{-7/2}, \epsilon^{-5/2}$, and $\epsilon^{-3/2}$ iterations (each iteration using $O(1)$ samples) when stochastic noises are in both level objectives, only in the upper-level objective, and not present (deterministic settings), respectively. We further show that if we employ momentum-assisted gradient estimators, the iteration complexities can be improved to $\epsilon^{-5/2}, \epsilon^{-4/2}$, and $\epsilon^{-3/2}$, respectively. We demonstrate even superior practical performance of the proposed method over existing second-order based approaches on MNIST data-hypercleaning experiments.  ( 2 min )

Graph Neural Networks (GNNs) are popular models for graph learning problems. GNNs show strong empirical performance in many practical tasks. However, the theoretical properties have not been completely elucidated. In this paper, we investigate whether GNNs can exploit the graph structure from the perspective of the expressive power of GNNs. In our analysis, we consider graph generation processes that are controlled by hidden node features, which contain all information about the graph structure. A typical example of this framework is kNN graphs constructed from the hidden features. In our main results, we show that GNNs can recover the hidden node features from the input graph alone, even when all node features, including the hidden features themselves and any indirect hints, are unavailable. GNNs can further use the recovered node features for downstream tasks. These results show that GNNs can fully exploit the graph structure by themselves, and in effect, GNNs can use both the hidden and explicit node features for downstream tasks. In the experiments, we confirm the validity of our results by showing that GNNs can accurately recover the hidden features using a GNN architecture built based on our theoretical analysis.  ( 2 min )

We extend the graph convolutional network method for deep learning on graph data to higher order in terms of neighboring nodes. In order to construct representations for a node in a graph, in addition to the features of the node and its immediate neighboring nodes, we also include more distant nodes in the calculations. In experimenting with a number of publicly available citation graph datasets, we show that this higher order neighbor visiting pays off by outperforming the original model especially when we have a limited number of available labeled data points for the training of the model.  ( 2 min )

Proactive edge association is capable of improving wireless connectivity at the cost of increased handover (HO) frequency and energy consumption, while relying on a large amount of private information sharing required for decision making. In order to improve the connectivity-cost trade-off without privacy leakage, we investigate the privacy-preserving joint edge association and power allocation (JEAPA) problem in the face of the environmental uncertainty and the infeasibility of individual learning. Upon modelling the problem by a decentralized partially observable Markov Decision Process (Dec-POMDP), it is solved by federated multi-agent reinforcement learning (FMARL) through only sharing encrypted training data for federatively learning the policy sought. Our simulation results show that the proposed solution strikes a compelling trade-off, while preserving a higher privacy level than the state-of-the-art solutions.  ( 2 min )

Topic models and all their variants analyse text by learning meaningful representations through word co-occurrences. As pointed out by Williamson et al. (2010), such models implicitly assume that the probability of a topic to be active and its proportion within each document are positively correlated. This correlation can be strongly detrimental in the case of documents created over time, simply because recent documents are likely better described by new and hence rare topics. In this work we leverage recent advances in neural variational inference and present an alternative neural approach to the dynamic Focused Topic Model. Indeed, we develop a neural model for topic evolution which exploits sequences of Bernoulli random variables in order to track the appearances of topics, thereby decoupling their activities from their proportions. We evaluate our model on three different datasets (the UN general debates, the collection of NeurIPS papers, and the ACL Anthology dataset) and show that it (i) outperforms state-of-the-art topic models in generalization tasks and (ii) performs comparably to them on prediction tasks, while employing roughly the same number of parameters, and converging about two times faster. Source code to reproduce our experiments is available online.  ( 2 min )

We empirically study the effect of noise scheduling strategies for denoising diffusion generative models. There are three findings: (1) the noise scheduling is crucial for the performance, and the optimal one depends on the task (e.g., image sizes), (2) when increasing the image size, the optimal noise scheduling shifts towards a noisier one (due to increased redundancy in pixels), and (3) simply scaling the input data by a factor of $b$ while keeping the noise schedule function fixed (equivalent to shifting the logSNR by $\log b$) is a good strategy across image sizes. This simple recipe, when combined with recently proposed Recurrent Interface Network (RIN), yields state-of-the-art pixel-based diffusion models for high-resolution images on ImageNet, enabling single-stage, end-to-end generation of diverse and high-fidelity images at 1024$\times$1024 resolution for the first time (without upsampling/cascades).  ( 2 min )

In this work, we consider learning sparse models in large scale settings, where the number of samples and the feature dimension can grow as large as millions or billions. Two immediate issues occur under such challenging scenario: (i) computational cost; (ii) memory overhead. In particular, the memory issue precludes a large volume of prior algorithms that are based on batch optimization technique. To remedy the problem, we propose to learn sparse models such as Lasso in an online manner where in each iteration, only one randomly chosen sample is revealed to update a sparse iterate. Thereby, the memory cost is independent of the sample size and gradient evaluation for one sample is efficient. Perhaps amazingly, we find that with the same parameter, sparsity promoted by batch methods is not preserved in online fashion. We analyze such interesting phenomenon and illustrate some effective variants including mini-batch methods and a hard thresholding based stochastic gradient algorithm. Extensive experiments are carried out on a public dataset which supports our findings and algorithms.  ( 2 min )

Due to its high cost-effectiveness, sparsity has become the most important approach for building efficient deep-learning models. However, commodity accelerators are built mainly for efficient dense computation, creating a huge gap for general sparse computation to leverage. Existing solutions have to use time-consuming compiling to improve the efficiency of sparse kernels in an ahead-of-time manner and thus are limited to static sparsity. A wide range of dynamic sparsity opportunities is missed because their sparsity patterns are only known at runtime. This limits the future of building more biological brain-like neural networks that should be dynamically and sparsely activated. In this paper, we bridge the gap between sparse computation and commodity accelerators by proposing a system, called Spider, for efficiently executing deep learning models with dynamic sparsity. We identify an important property called permutation invariant that applies to most deep-learning computations. The property enables Spider (1) to extract dynamic sparsity patterns of tensors that are only known at runtime with little overhead; and (2) to transform the dynamic sparse computation into an equivalent dense computation which has been extremely optimized on commodity accelerators. Extensive evaluation on diverse models shows Spider can extract and transform dynamic sparsity with negligible overhead but brings up to 9.4x speedup over state-of-art solutions.  ( 2 min )

We introduce a video framework for modeling the association between verbal and non-verbal communication during dyadic conversation. Given the input speech of a speaker, our approach retrieves a video of a listener, who has facial expressions that would be socially appropriate given the context. Our approach further allows the listener to be conditioned on their own goals, personalities, or backgrounds. Our approach models conversations through a composition of large language models and vision-language models, creating internal representations that are interpretable and controllable. To study multimodal communication, we propose a new video dataset of unscripted conversations covering diverse topics and demographics. Experiments and visualizations show our approach is able to output listeners that are significantly more socially appropriate than baselines. However, many challenges remain, and we release our dataset publicly to spur further progress. See our website for video results, data, and code: https://realtalk.cs.columbia.edu.  ( 2 min )

This paper surveys machine-learning-based super-resolution reconstruction for vortical flows. Super resolution aims to find the high-resolution flow fields from low-resolution data and is generally an approach used in image reconstruction. In addition to surveying a variety of recent super-resolution applications, we provide case studies of super-resolution analysis for an example of two-dimensional decaying isotropic turbulence. We demonstrate that physics-inspired model designs enable successful reconstruction of vortical flows from spatially limited measurements. We also discuss the challenges and outlooks of machine-learning-based super-resolution analysis for fluid flow applications. The insights gained from this study can be leveraged for super-resolution analysis of numerical and experimental flow data.  ( 2 min )

Risk-sensitive reinforcement learning (RL) has become a popular tool to control the risk of uncertain outcomes and ensure reliable performance in various sequential decision-making problems. While policy gradient methods have been developed for risk-sensitive RL, it remains unclear if these methods enjoy the same global convergence guarantees as in the risk-neutral case. In this paper, we consider a class of dynamic time-consistent risk measures, called Expected Conditional Risk Measures (ECRMs), and derive policy gradient updates for ECRM-based objective functions. Under both constrained direct parameterization and unconstrained softmax parameterization, we provide global convergence of the corresponding risk-averse policy gradient algorithms. We further test a risk-averse variant of REINFORCE algorithm on a stochastic Cliffwalk environment to demonstrate the efficacy of our algorithm and the importance of risk control.  ( 2 min )

To apply reinforcement learning (RL) to real-world applications, agents are required to adhere to the safety guidelines of their respective domains. Safe RL can effectively handle the guidelines by converting them into constraints of the RL problem. In this paper, we develop a safe distributional RL method based on the trust region method, which can satisfy constraints consistently. However, policies may not meet the safety guidelines due to the estimation bias of distributional critics, and importance sampling required for the trust region method can hinder performance due to its significant variance. Hence, we enhance safety performance through the following approaches. First, we train distributional critics to have low estimation biases using proposed target distributions where bias-variance can be traded off. Second, we propose novel surrogates for the trust region method expressed with Q-functions using the reparameterization trick. Additionally, depending on initial policy settings, there can be no policy satisfying constraints within a trust region. To handle this infeasible issue, we propose a gradient integration method which guarantees to find a policy satisfying all constraints from an unsafe initial policy. From extensive experiments, the proposed method with risk-averse constraints shows minimal constraint violations while achieving high returns compared to existing safe RL methods.  ( 2 min )

Estimation of value in policy gradient methods is a fundamental problem. Generalized Advantage Estimation (GAE) is an exponentially-weighted estimator of an advantage function similar to $\lambda$-return. It substantially reduces the variance of policy gradient estimates at the expense of bias. In practical applications, a truncated GAE is used due to the incompleteness of the trajectory, which results in a large bias during estimation. To address this challenge, instead of using the entire truncated GAE, we propose to take a part of it when calculating updates, which significantly reduces the bias resulting from the incomplete trajectory. We perform experiments in MuJoCo and $\mu$RTS to investigate the effect of different partial coefficient and sampling lengths. We show that our partial GAE approach yields better empirical results in both environments.  ( 2 min )

Federated Learning (FL) is a well-established technique for privacy preserving distributed training. Much attention has been given to various aspects of FL training. A growing number of applications that consume FL-trained models, however, increasingly operate under dynamically and unpredictably variable conditions, rendering a single model insufficient. We argue for training a global family of models cost efficiently in a federated fashion. Training them independently for different tradeoff points incurs $O(k)$ cost for any k architectures of interest, however. Straightforward applications of FL techniques to recent weight-shared training approaches is either infeasible or prohibitively expensive. We propose SuperFed - an architectural framework that incurs $O(1)$ cost to co-train a large family of models in a federated fashion by leveraging weight-shared learning. We achieve an order of magnitude cost savings on both communication and computation by proposing two novel training mechanisms: (a) distribution of weight-shared models to federated clients, (b) central aggregation of arbitrarily overlapping weight-shared model parameters. The combination of these mechanisms is shown to reach an order of magnitude (9.43x) reduction in computation and communication cost for training a $5*10^{18}$-sized family of models, compared to independently training as few as $k = 9$ DNNs without any accuracy loss.  ( 2 min )

Protein-ligand binding prediction is a fundamental problem in AI-driven drug discovery. Prior work focused on supervised learning methods using a large set of binding affinity data for small molecules, but it is hard to apply the same strategy to other drug classes like antibodies as labelled data is limited. In this paper, we explore unsupervised approaches and reformulate binding energy prediction as a generative modeling task. Specifically, we train an energy-based model on a set of unlabelled protein-ligand complexes using SE(3) denoising score matching and interpret its log-likelihood as binding affinity. Our key contribution is a new equivariant rotation prediction network called Neural Euler's Rotation Equations (NERE) for SE(3) score matching. It predicts a rotation by modeling the force and torque between protein and ligand atoms, where the force is defined as the gradient of an energy function with respect to atom coordinates. We evaluate NERE on protein-ligand and antibody-antigen binding affinity prediction benchmarks. Our model outperforms all unsupervised baselines (physics-based and statistical potentials) and matches supervised learning methods in the antibody case.  ( 2 min )

PPO (Proximal Policy Optimization) is a state-of-the-art policy gradient algorithm that has been successfully applied to complex computer games such as Dota 2 and Honor of Kings. In these environments, an agent makes compound actions consisting of multiple sub-actions. PPO uses clipping to restrict policy updates. Although clipping is simple and effective, it is not efficient in its sample use. For compound actions, most PPO implementations consider the joint probability (density) of sub-actions, which means that if the ratio of a sample (state compound-action pair) exceeds the range, the gradient the sample produces is zero. Instead, for each sub-action we calculate the loss separately, which is less prone to clipping during updates thereby making better use of samples. Further, we propose a multi-action mixed loss that combines joint and separate probabilities. We perform experiments in Gym-$\mu$RTS and MuJoCo. Our hybrid model improves performance by more than 50\% in different MuJoCo environments compared to OpenAI's PPO benchmark results. And in Gym-$\mu$RTS, we find the sub-action loss outperforms the standard PPO approach, especially when the clip range is large. Our findings suggest this method can better balance the use-efficiency and quality of samples.  ( 2 min )

This paper proposes a simple method to distill and detect backdoor patterns within an image: \emph{Cognitive Distillation} (CD). The idea is to extract the "minimal essence" from an input image responsible for the model's prediction. CD optimizes an input mask to extract a small pattern from the input image that can lead to the same model output (i.e., logits or deep features). The extracted pattern can help understand the cognitive mechanism of a model on clean vs. backdoor images and is thus called a \emph{Cognitive Pattern} (CP). Using CD and the distilled CPs, we uncover an interesting phenomenon of backdoor attacks: despite the various forms and sizes of trigger patterns used by different attacks, the CPs of backdoor samples are all surprisingly and suspiciously small. One thus can leverage the learned mask to detect and remove backdoor examples from poisoned training datasets. We conduct extensive experiments to show that CD can robustly detect a wide range of advanced backdoor attacks. We also show that CD can potentially be applied to help detect potential biases from face datasets. Code is available at \url{https://github.com/HanxunH/CognitiveDistillation}.  ( 2 min )

Introduction Data imbalance is one of the crucial issues in big data analysis with fewer labels. For example, in real-world healthcare data, spam detection labels, and financial fraud detection datasets. Many data balance methods were introduced to improve machine learning algorithms' performance. Research claims SMOTE and SMOTE-based data-augmentation (generate new data points) methods could improve algorithm performance. However, we found in many online tutorials, the valuation methods were applied based on synthesized datasets that introduced bias into the evaluation, and the performance got a false improvement. In this study, we proposed, a new evaluation framework for imbalanced data learning methods. We have experimented on five data balance methods and whether the performance of algorithms will improve or not. Methods We collected 8 imbalanced healthcare datasets with different imbalanced rates from different domains. Applied 6 data augmentation methods with 11 machine learning methods testing if the data augmentation will help with improving machine learning performance. We compared the traditional data augmentation evaluation methods with our proposed cross-validation evaluation framework Results Using traditional data augmentation evaluation meta hods will give a false impression of improving the performance. However, our proposed evaluation method shows data augmentation has limited ability to improve the results. Conclusion EFIDL is more suitable for evaluating the prediction performance of an ML method when data are augmented. Using an unsuitable evaluation framework will give false results. Future researchers should consider the evaluation framework we proposed when dealing with augmented datasets. Our experiments showed data augmentation does not help improve ML prediction performance.  ( 2 min )

On-device machine learning (ML) inference can enable the use of private user data on user devices without remote servers. However, a pure on-device solution to private ML inference is impractical for many applications that rely on embedding tables that are too large to be stored on-device. To overcome this barrier, we propose the use of private information retrieval (PIR) to efficiently and privately retrieve embeddings from servers without sharing any private information during on-device ML inference. As off-the-shelf PIR algorithms are usually too computationally intensive to directly use for latency-sensitive inference tasks, we 1) develop a novel algorithm for accelerating PIR on GPUs, and 2) co-design PIR with the downstream ML application to obtain further speedup. Our GPU acceleration strategy improves system throughput by more than $20 \times$ over an optimized CPU PIR implementation, and our co-design techniques obtain over $5 \times$ additional throughput improvement at fixed model quality. Together, on various on-device ML applications such as recommendation and language modeling, our system on a single V100 GPU can serve up to $100,000$ queries per second -- a $>100 \times$ throughput improvement over a naively implemented system -- while maintaining model accuracy, and limiting inference communication and response latency to within $300$KB and $<100$ms respectively.  ( 2 min )

While much effort has been devoted to deriving and studying effective convex formulations of signal processing problems, the gradients of convex functions also have critical applications ranging from gradient-based optimization to optimal transport. Recent works have explored data-driven methods for learning convex objectives, but learning their monotone gradients is seldom studied. In this work, we propose Cascaded and Modular Monotone Gradient Networks (C-MGN and M-MGN respectively), two monotone gradient neural network architectures for directly learning the gradients of convex functions. We show that our networks are simpler to train, learn monotone gradient fields more accurately, and use significantly fewer parameters than state of the art methods. We further demonstrate their ability to learn optimal transport mappings to augment driving image data.  ( 2 min )

Environmental damage has been of much concern, particularly coastal areas and the oceans given climate change and drastic effects of pollution and extreme climate events. Our present day analytical capabilities along with the advancements in information acquisition techniques such as remote sensing can be utilized for the management and study of coral reef ecosystems. In this paper, we present Reef-insight, an unsupervised machine learning framework that features advanced clustering methods and remote sensing for reef community mapping. Our framework compares different clustering methods to evaluate them for reef community mapping using remote sensing data. We evaluate four major clustering approaches such as k- means, hierarchical clustering, Gaussian mixture model, and density-based clustering based on qualitative and visual assessment. We utilise remote sensing data featuring Heron reef island region in the Great Barrier Reef of Australia. Our results indicate that clustering methods using remote sensing data can well identify benthic and geomorphic clusters that are found in reefs when compared to other studies. Our results indicate that Reef-insight can generate detailed reef community maps outlining distinct reef habitats and has the potential to enable further insights for reef restoration projects. We release our framework as open source software to enable its extension to different parts of the world  ( 2 min )

In response to disinformation and propaganda from Russian online media following the Russian invasion of Ukraine, Russian outlets including Russia Today and Sputnik News were banned throughout Europe. Many of these Russian outlets, in order to reach their audiences, began to heavily promote their content on messaging services like Telegram. In this work, to understand this phenomenon, we study how 16 Russian media outlets have interacted with and utilized 732 Telegram channels throughout 2022. To do this, we utilize a multilingual version of the foundational model MPNet to embed articles and Telegram messages in a shared embedding space and semantically compare content. Leveraging a parallelized version of DP-Means clustering, we perform paragraph-level topic/narrative extraction and time-series analysis with Hawkes Processes. With this approach, across our websites, we find between 2.3% (ura.news) and 26.7% (ukraina.ru) of their content originated/resulted from activity on Telegram. Finally, tracking the spread of individual narratives, we measure the rate at which these websites and channels disseminate content within the Russian media ecosystem.  ( 2 min )

We present AIRS: Automatic Intrinsic Reward Shaping that intelligently and adaptively provides high-quality intrinsic rewards to enhance exploration in reinforcement learning (RL). More specifically, AIRS selects shaping function from a predefined set based on the estimated task return in real-time, providing reliable exploration incentives and alleviating the biased objective problem. Moreover, we develop an intrinsic reward toolkit to provide efficient and reliable implementations of diverse intrinsic reward approaches. We test AIRS on various tasks of Procgen games and DeepMind Control Suite. Extensive simulation demonstrates that AIRS can outperform the benchmarking schemes and achieve superior performance with simple architecture.  ( 2 min )

Pruning is a standard technique for reducing the computational cost of deep networks. Many advances in pruning leverage concepts from the Lottery Ticket Hypothesis (LTH). LTH reveals that inside a trained dense network exists sparse subnetworks (tickets) able to achieve similar accuracy (i.e., win the lottery - winning tickets). Pruning at initialization focuses on finding winning tickets without training a dense network. Studies on these concepts share the trend that subnetworks come from weight or filter pruning. In this work, we investigate LTH and pruning at initialization from the lens of layer pruning. First, we confirm the existence of winning tickets when the pruning process removes layers. Leveraged by this observation, we propose to discover these winning tickets at initialization, eliminating the requirement of heavy computational resources for training the initial (over-parameterized) dense network. Extensive experiments show that our winning tickets notably speed up the training phase and reduce up to 51% of carbon emission, an important step towards democratization and green Artificial Intelligence. Beyond computational benefits, our winning tickets exhibit robustness against adversarial and out-of-distribution examples. Finally, we show that our subnetworks easily win the lottery at initialization while tickets from filter removal (the standard structured LTH) hardly become winning tickets.  ( 2 min )

The state-of-the-art predictive maintenance (PdM) techniques have shown great success in reducing maintenance costs and downtime of complicated machines while increasing overall productivity through extensive utilization of Internet-of-Things (IoT) and Deep Learning (DL). Unfortunately, IoT sensors and DL algorithms are both prone to cyber-attacks. For instance, DL algorithms are known for their susceptibility to adversarial examples. Such adversarial attacks are vastly under-explored in the PdM domain. This is because the adversarial attacks in the computer vision domain for classification tasks cannot be directly applied to the PdM domain for multivariate time series (MTS) regression tasks. In this work, we propose an end-to-end methodology to design adversarially robust PdM systems by extensively analyzing the effect of different types of adversarial attacks and proposing a novel adversarial defense technique for DL-enabled PdM models. First, we propose novel MTS Projected Gradient Descent (PGD) and MTS PGD with random restarts (PGD_r) attacks. Then, we evaluate the impact of MTS PGD and PGD_r along with MTS Fast Gradient Sign Method (FGSM) and MTS Basic Iterative Method (BIM) on Long Short-Term Memory (LSTM), Gated Recurrent Unit (GRU), Convolutional Neural Network (CNN), and Bi-directional LSTM based PdM system. Our results using NASA's turbofan engine dataset show that adversarial attacks can cause a severe defect (up to 11X) in the RUL prediction, outperforming the effectiveness of the state-of-the-art PdM attacks by 3X. Furthermore, we present a novel approximate adversarial training method to defend against adversarial attacks. We observe that approximate adversarial training can significantly improve the robustness of PdM models (up to 54X) and outperforms the state-of-the-art PdM defense methods by offering 3X more robustness.  ( 2 min )

We introduce the Salesforce CausalAI Library, an open-source library for causal analysis using observational data. It supports causal discovery and causal inference for tabular and time series data, of both discrete and continuous types. This library includes algorithms that handle linear and non-linear causal relationships between variables, and uses multi-processing for speed-up. We also include a data generator capable of generating synthetic data with specified structural equation model for both the aforementioned data formats and types, that helps users control the ground-truth causal process while investigating various algorithms. Finally, we provide a user interface (UI) that allows users to perform causal analysis on data without coding. The goal of this library is to provide a fast and flexible solution for a variety of problems in the domain of causality. This technical report describes the Salesforce CausalAI API along with its capabilities, the implementations of the supported algorithms, and experiments demonstrating their performance and speed. Our library is available at \url{https://github.com/salesforce/causalai}.  ( 2 min )

Social turbulence can affect people financial decisions, causing changes in spending and saving. During a global turbulence as significant as the COVID-19 pandemic, such changes are inevitable. Here we examine how the effects of COVID-19 on various jurisdictions influenced the global price of Bitcoin. We hypothesize that lock downs and expectations of economic recession erode people trust in fiat (government-issued) currencies, thus elevating cryptocurrencies. Hence, we expect to identify a causal relation between the turbulence caused by the pandemic, demand for Bitcoin, and ultimately its price. To test the hypothesis, we merged datasets of Bitcoin prices and COVID-19 cases and deaths. We also engineered extra features and applied statistical and machine learning (ML) models. We applied a Random Forest model (RF) to identify and rank the feature importance, and ran a Long Short-Term Memory (LSTM) model on Bitcoin prices data set twice: with and without accounting for COVID-19 related features. We find that adding COVID-19 data into the LSTM model improved prediction of Bitcoin prices.  ( 2 min )

In this paper, we prove that separable negative log-likelihood losses for structured prediction are not necessarily Bayes consistent, or, in other words, minimizing these losses may not result in a model that predicts the most probable structure in the data distribution for a given input. This fact opens the question of whether these losses are well-adapted for structured prediction and, if so, why.  ( 2 min )

Much hope for finding new physics phenomena at microscopic scale relies on the observations obtained from High Energy Physics experiments, like the ones performed at the Large Hadron Collider (LHC). However, current experiments do not indicate clear signs of new physics that could guide the development of additional Beyond Standard Model (BSM) theories. Identifying signatures of new physics out of the enormous amount of data produced at the LHC falls into the class of anomaly detection and constitutes one of the greatest computational challenges. In this article, we propose a novel strategy to perform anomaly detection in a supervised learning setting, based on the artificial creation of anomalies through a random process. For the resulting supervised learning problem, we successfully apply classical and quantum Support Vector Classifiers (CSVC and QSVC respectively) to identify the artificial anomalies among the SM events. Even more promising, we find that employing an SVC trained to identify the artificial anomalies, it is possible to identify realistic BSM events with high accuracy. In parallel, we also explore the potential of quantum algorithms for improving the classification accuracy and provide plausible conditions for the best exploitation of this novel computational paradigm.  ( 2 min )

As the bias issue is being taken more and more seriously in widely applied machine learning systems, the decrease in accuracy in most cases deeply disturbs researchers when increasing fairness. To address this problem, we present a novel analysis of the expected fairness quality via weighted vote, suitable for both binary and multi-class classification. The analysis takes the correction of biased predictions by ensemble members into account and provides learning bounds that are amenable to efficient minimisation. We further propose a pruning method based on this analysis and the concepts of domination and Pareto optimality, which is able to increase fairness under a prerequisite of little or even no accuracy decline. The experimental results indicate that the proposed learning bounds are faithful and that the proposed pruning method can indeed increase ensemble fairness without much accuracy degradation.  ( 2 min )

Disease heterogeneity has been a critical challenge for precision diagnosis and treatment, especially in neurologic and neuropsychiatric diseases. Many diseases can display multiple distinct brain phenotypes across individuals, potentially reflecting disease subtypes that can be captured using MRI and machine learning methods. However, biological interpretability and treatment relevance are limited if the derived subtypes are not associated with genetic drivers or susceptibility factors. Herein, we describe Gene-SGAN - a multi-view, weakly-supervised deep clustering method - which dissects disease heterogeneity by jointly considering phenotypic and genetic data, thereby conferring genetic correlations to the disease subtypes and associated endophenotypic signatures. We first validate the generalizability, interpretability, and robustness of Gene-SGAN in semi-synthetic experiments. We then demonstrate its application to real multi-site datasets from 28,858 individuals, deriving subtypes of Alzheimer's disease and brain endophenotypes associated with hypertension, from MRI and SNP data. Derived brain phenotypes displayed significant differences in neuroanatomical patterns, genetic determinants, biological and clinical biomarkers, indicating potentially distinct underlying neuropathologic processes, genetic drivers, and susceptibility factors. Overall, Gene-SGAN is broadly applicable to disease subtyping and endophenotype discovery, and is herein tested on disease-related, genetically-driven neuroimaging phenotypes.  ( 2 min )

We propose a new strategy for anomaly detection at the LHC based on unsupervised quantum machine learning algorithms. To accommodate the constraints on the problem size dictated by the limitations of current quantum hardware we develop a classical convolutional autoencoder. The designed quantum anomaly detection models, namely an unsupervised kernel machine and two clustering algorithms, are trained to find new-physics events in the latent representation of LHC data produced by the autoencoder. The performance of the quantum algorithms is benchmarked against classical counterparts on different new-physics scenarios and its dependence on the dimensionality of the latent space and the size of the training dataset is studied. For kernel-based anomaly detection, we identify a regime where the quantum model significantly outperforms its classical counterpart. An instance of the kernel machine is implemented on a quantum computer to verify its suitability for available hardware. We demonstrate that the observed consistent performance advantage is related to the inherent quantum properties of the circuit used.  ( 2 min )

Probability forecasts for binary outcomes, often referred to as probabilistic classifiers or confidence scores, are ubiquitous in science and society, and methods for evaluating and comparing them are in great demand. We propose and study a triptych of diagnostic graphics that focus on distinct and complementary aspects of forecast performance: The reliability diagram addresses calibration, the receiver operating characteristic (ROC) curve diagnoses discrimination ability, and the Murphy diagram visualizes overall predictive performance and value. A Murphy curve shows a forecast's mean elementary scores, including the widely used misclassification rate, and the area under a Murphy curve equals the mean Brier score. For a calibrated forecast, the reliability curve lies on the diagonal, and for competing calibrated forecasts, the ROC and Murphy curves share the same number of crossing points. We invoke the recently developed CORP (Consistent, Optimally binned, Reproducible, and Pool-Adjacent-Violators (PAV) algorithm based) approach to craft reliability diagrams and decompose a mean score into miscalibration (MCB), discrimination (DSC), and uncertainty (UNC) components. Plots of the DSC measure of discrimination ability versus the calibration metric MCB visualize classifier performance across multiple competitors. The proposed tools are illustrated in empirical examples from astrophysics, economics, and social science.  ( 2 min )

Graph neural networks (GNNs) achieve remarkable performance in graph machine learning tasks but can be hard to train on large-graph data, where their learning dynamics are not well understood. We investigate the training dynamics of large-graph GNNs using graph neural tangent kernels (GNTKs) and graphons. In the limit of large width, optimization of an overparametrized NN is equivalent to kernel regression on the NTK. Here, we investigate how the GNTK evolves as another independent dimension is varied: the graph size. We use graphons to define limit objects -- graphon NNs for GNNs, and graphon NTKs for GNTKs, and prove that, on a sequence of growing graphs, the GNTKs converge to the graphon NTK. We further prove that the eigenspaces of the GNTK, which are related to the problem learning directions and associated learning speeds, converge to the spectrum of the GNTK. This implies that in the large-graph limit, the GNTK fitted on a graph of moderate size can be used to solve the same task on the large-graph and infer the learning dynamics of the large-graph GNN. These results are verified empirically on node regression and node classification tasks.  ( 2 min )

Learning from 3D biological macromolecules with artificial intelligence technologies has been an emerging area. Computational protein design, known as the inverse of protein structure prediction, aims to generate protein sequences that will fold into the defined structure. Analogous to protein design, RNA design is also an important topic in synthetic biology, which aims to generate RNA sequences by given structures. However, existing RNA design methods mainly focus on the secondary structure, ignoring the informative tertiary structure, which is commonly used in protein design. To explore the complex coupling between RNA sequence and 3D structure, we introduce an RNA tertiary structure modeling method to efficiently capture useful information from the 3D structure of RNA. For a fair comparison, we collect abundant RNA data and split the data according to tertiary structures. With the standard dataset, we conduct a benchmark by employing structure-based protein design approaches with our RNA tertiary structure modeling method. We believe our work will stimulate the future development of tertiary structure-based RNA design and bridge the gap between the RNA 3D structures and sequences.  ( 2 min )

The two key characteristics of a normalizing flow is that it is invertible (in particular, dimension preserving) and that it monitors the amount by which it changes the likelihood of data points as samples are propagated along the network. Recently, multiple generalizations of normalizing flows have been introduced that relax these two conditions. On the other hand, neural networks only perform a forward pass on the input, there is neither a notion of an inverse of a neural network nor is there one of its likelihood contribution. In this paper we argue that certain neural network architectures can be enriched with a stochastic inverse pass and that their likelihood contribution can be monitored in a way that they fall under the generalized notion of a normalizing flow mentioned above. We term this enrichment flowification. We prove that neural networks only containing linear layers, convolutional layers and invertible activations such as LeakyReLU can be flowified and evaluate them in the generative setting on image datasets.  ( 2 min )

The problem of piecewise affine (PWA) regression and planning is of foundational importance to the study of online learning, control, and robotics, where it provides a theoretically and empirically tractable setting to study systems undergoing sharp changes in the dynamics. Unfortunately, due to the discontinuities that arise when crossing into different ``pieces,'' learning in general sequential settings is impossible and practical algorithms are forced to resort to heuristic approaches. This paper builds on the recently developed smoothed online learning framework and provides the first algorithms for prediction and simulation in PWA systems whose regret is polynomial in all relevant problem parameters under a weak smoothness assumption; moreover, our algorithms are efficient in the number of calls to an optimization oracle. We further apply our results to the problems of one-step prediction and multi-step simulation regret in piecewise affine dynamical systems, where the learner is tasked with simulating trajectories and regret is measured in terms of the Wasserstein distance between simulated and true data. Along the way, we develop several technical tools of more general interest.  ( 2 min )

We present a novel methodology for integrating high resolution longitudinal data with the dynamic prediction capabilities of survival models. The aim is two-fold: to improve the predictive power while maintaining interpretability of the models. To go beyond the black box paradigm of artificial neural networks, we propose a parsimonious and robust semi-parametric approach (i.e., a landmarking competing risks model) that combines routinely collected low-resolution data with predictive features extracted from a convolutional neural network, that was trained on high resolution time-dependent information. We then use saliency maps to analyze and explain the extra predictive power of this model. To illustrate our methodology, we focus on healthcare-associated infections in patients admitted to an intensive care unit.  ( 2 min )

We provide a theoretical framework for Reinforcement Learning with Human Feedback (RLHF). Our analysis shows that when the true reward function is linear, the widely used maximum likelihood estimator (MLE) converges under both the Bradley-Terry-Luce (BTL) model and the Plackett-Luce (PL) model. However, we show that when training a policy based on the learned reward model, MLE fails while a pessimistic MLE provides policies with improved performance under certain coverage assumptions. Additionally, we demonstrate that under the PL model, the true MLE and an alternative MLE that splits the $K$-wise comparison into pairwise comparisons both converge. Moreover, the true MLE is asymptotically more efficient. Our results validate the empirical success of existing RLHF algorithms in InstructGPT and provide new insights for algorithm design. Furthermore, our results unify the problem of RLHF and Max Entropy Inverse Reinforcement Learning, and provide the first sample complexity bound for both problems.  ( 2 min )

Recently, many works studied the expressive power of graph neural networks (GNNs) by linking it to the $1$-dimensional Weisfeiler--Leman algorithm ($1\text{-}\mathsf{WL}$). Here, the $1\text{-}\mathsf{WL}$ is a well-studied heuristic for the graph isomorphism problem, which iteratively colors or partitions a graph's vertex set. While this connection has led to significant advances in understanding and enhancing GNNs' expressive power, it does not provide insights into their generalization performance, i.e., their ability to make meaningful predictions beyond the training set. In this paper, we study GNNs' generalization ability through the lens of Vapnik--Chervonenkis (VC) dimension theory in two settings, focusing on graph-level predictions. First, when no upper bound on the graphs' order is known, we show that the bitlength of GNNs' weights tightly bounds their VC dimension. Further, we derive an upper bound for GNNs' VC dimension using the number of colors produced by the $1\text{-}\mathsf{WL}$. Secondly, when an upper bound on the graphs' order is known, we show a tight connection between the number of graphs distinguishable by the $1\text{-}\mathsf{WL}$ and GNNs' VC dimension. Our empirical study confirms the validity of our theoretical findings.  ( 2 min )

Despite the remarkable performance and generalization levels of deep learning models in a wide range of artificial intelligence tasks, it has been demonstrated that these models can be easily fooled by the addition of imperceptible yet malicious perturbations to natural inputs. These altered inputs are known in the literature as adversarial examples. In this paper, we propose a novel probabilistic framework to generalize and extend adversarial attacks in order to produce a desired probability distribution for the classes when we apply the attack method to a large number of inputs. This novel attack paradigm provides the adversary with greater control over the target model, thereby exposing, in a wide range of scenarios, threats against deep learning models that cannot be conducted by the conventional paradigms. We introduce four different strategies to efficiently generate such attacks, and illustrate our approach by extending multiple adversarial attack algorithms. We also experimentally validate our approach for the spoken command classification task and the Tweet emotion classification task, two exemplary machine learning problems in the audio and text domain, respectively. Our results demonstrate that we can closely approximate any probability distribution for the classes while maintaining a high fooling rate and even prevent the attacks from being detected by label-shift detection methods.  ( 2 min )

In this paper, we study the predict-then-optimize problem where the output of a machine learning prediction task is used as the input of some downstream optimization problem, say, the objective coefficient vector of a linear program. The problem is also known as predictive analytics or contextual linear programming. The existing approaches largely suffer from either (i) optimization intractability (a non-convex objective function)/statistical inefficiency (a suboptimal generalization bound) or (ii) requiring strong condition(s) such as no constraint or loss calibration. We develop a new approach to the problem called \textit{maximum optimality margin} which designs the machine learning loss function by the optimality condition of the downstream optimization. The max-margin formulation enjoys both computational efficiency and good theoretical properties for the learning procedure. More importantly, our new approach only needs the observations of the optimal solution in the training data rather than the objective function, which makes it a new and natural approach to the inverse linear programming problem under both contextual and context-free settings; we also analyze the proposed method under both offline and online settings, and demonstrate its performance using numerical experiments.  ( 2 min )

Most classification models treat all misclassifications equally. However, different classes may be related, and these hierarchical relationships must be considered in some classification problems. These problems can be addressed by using hierarchical information during training. Unfortunately, this information is not available for all datasets. Many classification-based metric learning methods use class representatives in embedding space to represent different classes. The relationships among the learned class representatives can then be used to estimate class hierarchical structures. If we have a predefined class hierarchy, the learned class representatives can be assessed to determine whether the metric learning model learned semantic distances that match our prior knowledge. In this work, we train a softmax classifier and three metric learning models with several training options on benchmark and real-world datasets. In addition to the standard classification accuracy, we evaluate the hierarchical inference performance by inspecting learned class representatives and the hierarchy-informed performance, i.e., the classification performance, and the metric learning performance by considering predefined hierarchical structures. Furthermore, we investigate how the considered measures are affected by various models and training options. When our proposed ProxyDR model is trained without using predefined hierarchical structures, the hierarchical inference performance is significantly better than that of the popular NormFace model. Additionally, our model enhances some hierarchy-informed performance measures under the same training options. We also found that convolutional neural networks (CNNs) with random weights correspond to the predefined hierarchies better than random chance.  ( 2 min )

We consider the problem of performing Bayesian inference in probabilistic models where observations are accompanied by uncertainty, referred to as "uncertain evidence." We explore how to interpret uncertain evidence, and by extension the importance of proper interpretation as it pertains to inference about latent variables. We consider a recently-proposed method "distributional evidence" as well as revisit two older methods: Jeffrey's rule and virtual evidence. We devise guidelines on how to account for uncertain evidence and we provide new insights, particularly regarding consistency. To showcase the impact of different interpretations of the same uncertain evidence, we carry out experiments in which one interpretation is defined as "correct." We then compare inference results from each different interpretation illustrating the importance of careful consideration of uncertain evidence.  ( 2 min )

In this work, we propose a novel framework for estimating the dimension of the data manifold using a trained diffusion model. A diffusion model approximates the score function i.e. the gradient of the log density of a noise-corrupted version of the target distribution for varying levels of corruption. If the data concentrates around a manifold embedded in the high-dimensional ambient space, then as the level of corruption decreases, the score function points towards the manifold, as this direction becomes the direction of maximal likelihood increase. Therefore, for small levels of corruption, the diffusion model provides us with access to an approximation of the normal bundle of the data manifold. This allows us to estimate the dimension of the tangent space, thus, the intrinsic dimension of the data manifold. To the best of our knowledge, our method is the first deep-learning based estimator of the data manifold dimension and it outperforms well established statistical estimators in controlled experiments on both Euclidean and image data.  ( 2 min )

Learning accurate predictive models of real-world dynamic phenomena (e.g., climate, biological) remains a challenging task. One key issue is that the data generated by both natural and artificial processes often comprise time series that are irregularly sampled and/or contain missing observations. In this work, we propose the Neural Continuous-Discrete State Space Model (NCDSSM) for continuous-time modeling of time series through discrete-time observations. NCDSSM employs auxiliary variables to disentangle recognition from dynamics, thus requiring amortized inference only for the auxiliary variables. Leveraging techniques from continuous-discrete filtering theory, we demonstrate how to perform accurate Bayesian inference for the dynamic states. We propose three flexible parameterizations of the latent dynamics and an efficient training objective that marginalizes the dynamic states during inference. Empirical results on multiple benchmark datasets across various domains show improved imputation and forecasting performance of NCDSSM over existing models.  ( 2 min )

Proximal causal inference was recently proposed as a framework to identify causal effects from observational data in the presence of hidden confounders for which proxies are available. In this paper, we extend the proximal causal inference approach to settings where identification of causal effects hinges upon a set of mediators which are not observed, yet error prone proxies of the hidden mediators are measured. Specifically, (i) We establish causal hidden mediation analysis, which extends classical causal mediation analysis methods for identifying natural direct and indirect effects under no unmeasured confounding to a setting where the mediator of interest is hidden, but proxies of it are available. (ii) We establish hidden front-door criterion, which extends the classical front-door criterion to allow for hidden mediators for which proxies are available. (iii) We show that the identification of a certain causal effect called population intervention indirect effect remains possible with hidden mediators in settings where challenges in (i) and (ii) might co-exist. We view (i)-(iii) as important steps towards the practical application of front-door criteria and mediation analysis as mediators are almost always measured with error and thus, the most one can hope for in practice is that the measurements are at best proxies of mediating mechanisms. We propose identification approaches for the parameters of interest in our considered models. For the estimation aspect, we propose an influence function-based estimation method and provide an analysis for the robustness of the estimators.  ( 2 min )

It is challenging to guide neural network (NN) learning with prior knowledge. In contrast, many known properties, such as spatial smoothness or seasonality, are straightforward to model by choosing an appropriate kernel in a Gaussian process (GP). Many deep learning applications could be enhanced by modeling such known properties. For example, convolutional neural networks (CNNs) are frequently used in remote sensing, which is subject to strong seasonal effects. We propose to blend the strengths of deep learning and the clear modeling capabilities of GPs by using a composite kernel that combines a kernel implicitly defined by a neural network with a second kernel function chosen to model known properties (e.g., seasonality). We implement this idea by combining a deep network and an efficient mapping based on the Nystrom approximation, which we call Implicit Composite Kernel (ICK). We then adopt a sample-then-optimize approach to approximate the full GP posterior distribution. We demonstrate that ICK has superior performance and flexibility on both synthetic and real-world data sets. We believe that ICK framework can be used to include prior information into neural networks in many applications.  ( 2 min )

We report on what seems to be an intriguing connection between variable integration time and partial velocity refreshment of Ideal Hamiltonian Monte Carlo samplers, both of which can be used for reducing the dissipative behavior of the dynamics. More concretely, we show that on quadratic potentials, efficiency can be improved through these means by a $\sqrt{\kappa}$ factor in Wasserstein-2 distance, compared to classical constant integration time, fully refreshed HMC. We additionally explore the benefit of randomized integrators for simulating the Hamiltonian dynamics under higher order regularity conditions.  ( 2 min )

We present an application of conformal prediction, a form of uncertainty quantification with guarantees, to the detection of railway signals. State-of-the-art architectures are tested and the most promising one undergoes the process of conformalization, where a correction is applied to the predicted bounding boxes (i.e. to their height and width) such that they comply with a predefined probability of success. We work with a novel exploratory dataset of images taken from the perspective of a train operator, as a first step to build and validate future trustworthy machine learning models for the detection of railway signals.  ( 2 min )

We consider the Scale-Free Adversarial Multi-Armed Bandit (MAB) problem with unrestricted feedback delays. In contrast to the standard assumption that all losses are $[0,1]$-bounded, in our setting, losses can fall in a general bounded interval $[-L, L]$, unknown to the agent beforehand. Furthermore, the feedback of each arm pull can experience arbitrary delays. We propose a novel approach named Scale-Free Delayed INF (SFD-INF) for this novel setting, which combines a recent "convex combination trick" together with a novel doubling and skipping technique. We then present two instances of SFD-INF, each with carefully designed delay-adapted learning scales. The first one SFD-TINF uses $\frac 12$-Tsallis entropy regularizer and can achieve $\widetilde{\mathcal O}(\sqrt{K(D+T)}L)$ regret when the losses are non-negative, where $K$ is the number of actions, $T$ is the number of steps, and $D$ is the total feedback delay. This bound nearly matches the $\Omega((\sqrt{KT}+\sqrt{D\log K})L)$ lower-bound when regarding $K$ as a constant independent of $T$. The second one, SFD-LBINF, works for general scale-free losses and achieves a small-loss style adaptive regret bound $\widetilde{\mathcal O}(\sqrt{K\mathbb{E}[\tilde{\mathfrak L}_T^2]}+\sqrt{KDL})$, which falls to the $\widetilde{\mathcal O}(\sqrt{K(D+T)}L)$ regret in the worst case and is thus more general than SFD-TINF despite a more complicated analysis and several extra logarithmic dependencies. Moreover, both instances also outperform the existing algorithms for non-delayed (i.e., $D=0$) scale-free adversarial MAB problems, which can be of independent interest.  ( 2 min )

Probability forecasts for binary outcomes, often referred to as probabilistic classifiers or confidence scores, are ubiquitous in science and society, and methods for evaluating and comparing them are in great demand. We propose and study a triptych of diagnostic graphics that focus on distinct and complementary aspects of forecast performance: The reliability diagram addresses calibration, the receiver operating characteristic (ROC) curve diagnoses discrimination ability, and the Murphy diagram visualizes overall predictive performance and value. A Murphy curve shows a forecast's mean elementary scores, including the widely used misclassification rate, and the area under a Murphy curve equals the mean Brier score. For a calibrated forecast, the reliability curve lies on the diagonal, and for competing calibrated forecasts, the ROC and Murphy curves share the same number of crossing points. We invoke the recently developed CORP (Consistent, Optimally binned, Reproducible, and Pool-Adjacent-Violators (PAV) algorithm based) approach to craft reliability diagrams and decompose a mean score into miscalibration (MCB), discrimination (DSC), and uncertainty (UNC) components. Plots of the DSC measure of discrimination ability versus the calibration metric MCB visualize classifier performance across multiple competitors. The proposed tools are illustrated in empirical examples from astrophysics, economics, and social science.  ( 2 min )

We propose Banker-OMD, a novel framework generalizing the classical Online Mirror Descent (OMD) technique in online learning algorithm design. Banker-OMD allows algorithms to robustly handle delayed feedback, and offers a general methodology for achieving $\tilde{O}(\sqrt{T} + \sqrt{D})$-style regret bounds in various delayed-feedback online learning tasks, where $T$ is the time horizon length and $D$ is the total feedback delay. We demonstrate the power of Banker-OMD with applications to three important bandit scenarios with delayed feedback, including delayed adversarial Multi-armed bandits (MAB), delayed adversarial linear bandits, and a novel delayed best-of-both-worlds MAB setting. Banker-OMD achieves nearly-optimal performance in all the three settings. In particular, it leads to the first delayed adversarial linear bandit algorithm achieving $\tilde{O}(\text{poly}(n)(\sqrt{T} + \sqrt{D}))$ regret.  ( 2 min )

Efficiently and flexibly estimating treatment effect heterogeneity is an important task in a wide variety of settings ranging from medicine to marketing, and there are a considerable number of promising conditional average treatment effect estimators currently available. These, however, typically rely on the assumption that the measured covariates are enough to justify conditional exchangeability. We propose the P-learner, motivated by the R-learner, a tailored two-stage loss function for learning heterogeneous treatment effects in settings where exchangeability given observed covariates is an implausible assumption, and we wish to rely on proxy variables for causal inference. Our proposed estimator can be implemented by off-the-shelf loss-minimizing machine learning methods, which in the case of kernel regression satisfies an oracle bound on the estimated error as long as the nuisance components are estimated reasonably well.  ( 2 min )

We investigate properties of goodness-of-fit tests based on the Kernel Stein Discrepancy (KSD). We introduce a strategy to construct a test, called KSDAgg, which aggregates multiple tests with different kernels. KSDAgg avoids splitting the data to perform kernel selection (which leads to a loss in test power), and rather maximises the test power over a collection of kernels. We provide non-asymptotic guarantees on the power of KSDAgg: we show it achieves the smallest uniform separation rate of the collection, up to a logarithmic term. For compactly supported densities with bounded model score function, we derive the rate for KSDAgg over restricted Sobolev balls; this rate corresponds to the minimax optimal rate over unrestricted Sobolev balls, up to an iterated logarithmic term. KSDAgg can be computed exactly in practice as it relies either on a parametric bootstrap or on a wild bootstrap to estimate the quantiles and the level corrections. In particular, for the crucial choice of bandwidth of a fixed kernel, it avoids resorting to arbitrary heuristics (such as median or standard deviation) or to data splitting. We find on both synthetic and real-world data that KSDAgg outperforms other state-of-the-art quadratic-time adaptive KSD-based goodness-of-fit testing procedures.  ( 2 min )

In recent years, particle-based variational inference (ParVI) methods such as Stein variational gradient descent (SVGD) have grown in popularity as scalable methods for Bayesian inference. Unfortunately, the properties of such methods invariably depend on hyperparameters such as the learning rate, which must be carefully tuned by the practitioner in order to ensure convergence to the target measure at a suitable rate. In this paper, we introduce a suite of new particle-based methods for scalable Bayesian inference based on coin betting, which are entirely learning-rate free. We illustrate the performance of our approach on a range of numerical examples, including several high-dimensional models and datasets, demonstrating comparable performance to other ParVI algorithms.  ( 2 min )

We propose a clustering method that involves chaining four known techniques into a pipeline yielding an algorithm with stronger recovery guarantees than any of the four components separately. Given $n$ points in $\mathbb R^d$, the first component of our pipeline, which we call leapfrog distances, is reminiscent of density-based clustering, yielding an $n\times n$ distance matrix. The leapfrog distances are then translated to new embeddings using multidimensional scaling and spectral methods, two other known techniques, yielding new embeddings of the $n$ points in $\mathbb R^{d'}$, where $d'$ satisfies $d'\ll d$ in general. Finally, sum-of-norms (SON) clustering is applied to the re-embedded points. Although the fourth step (SON clustering) can in principle be replaced by any other clustering method, our focus is on provable guarantees of recovery of underlying structure. Therefore, we establish that the re-embedding improves recovery SON clustering, since SON clustering is a well-studied method that already has provable guarantees.  ( 2 min )

Modern health care systems are conducting continuous, automated surveillance of the electronic medical record (EMR) to identify adverse events with increasing frequency; however, many events such as sepsis do not have elucidated prodromes (i.e., event chains) that can be used to identify and intercept the adverse event early in its course. Currently, there does not exist reliable framework for discovering or describing causal chains that precede adverse hospital events. Clinically relevant and interpretable results require a framework that can (1) infer temporal interactions across multiple patient features found in EMR data (e.g., labs, vital signs, etc.) and (2) can identify patterns that precede and are specific to an impending adverse event (e.g., sepsis). In this work, we propose a linear multivariate Hawkes process model, coupled with ReLU link function, to recover a Granger Causal (GC) graph with both exciting and inhibiting effects. We develop a scalable two-phase gradient-based method to maximize a surrogate-likelihood and estimate the problem parameters, which is shown to be effective via extensive numerical simulation. Our method is subsequently extended to a data set of patients admitted to an academic level 1 trauma center located in Atalanta, GA, where the estimated GC graph identifies several highly interpretable chains that precede sepsis. Here, we demonstrate the effectiveness of our approach in learning a GC graph over Sepsis Associated Derangements (SADs), but it can be generalized to other applications with similar requirements.  ( 2 min )

We propose a series of computationally efficient nonparametric tests for the two-sample, independence, and goodness-of-fit problems, using the Maximum Mean Discrepancy (MMD), Hilbert Schmidt Independence Criterion (HSIC), and Kernel Stein Discrepancy (KSD), respectively. Our test statistics are incomplete $U$-statistics, with a computational cost that interpolates between linear time in the number of samples, and quadratic time, as associated with classical $U$-statistic tests. The three proposed tests aggregate over several kernel bandwidths to detect departures from the null on various scales: we call the resulting tests MMDAggInc, HSICAggInc and KSDAggInc. This procedure provides a solution to the fundamental kernel selection problem as we can aggregate a large number of kernels with several bandwidths without incurring a significant loss of test power. For the test thresholds, we derive a quantile bound for wild bootstrapped incomplete $U$-statistics, which is of independent interest. We derive non-asymptotic uniform separation rates for MMDAggInc and HSICAggInc, and quantify exactly the trade-off between computational efficiency and the attainable rates: this result is novel for tests based on incomplete $U$-statistics, to our knowledge. We further show that in the quadratic-time case, the wild bootstrap incurs no penalty to test power over the more widespread permutation-based approach, since both attain the same minimax optimal rates (which in turn match the rates that use oracle quantiles). We support our claims with numerical experiments on the trade-off between computational efficiency and test power. In all three testing frameworks, the linear-time versions of our proposed tests perform at least as well as the current linear-time state-of-the-art tests.  ( 2 min )

Mesoscale structures are an integral part of the abstraction and analysis of complex systems. They reveal a node's function in the network, and facilitate our understanding of the network dynamics. For example, they can represent communities in social or citation networks, roles in corporate interactions, or core-periphery structures in transportation networks. We usually detect mesoscale structures under the assumption of independence of interactions. Still, in many cases, the interactions invalidate this assumption by occurring in a specific order. Such patterns emerge in pathway data; to capture them, we have to model the dependencies between interactions using higher-order network models. However, the detection of mesoscale structures in higher-order networks is still under-researched. In this work, we derive a Bayesian approach that simultaneously models the optimal partitioning of nodes in groups and the optimal higher-order network dynamics between the groups. In synthetic data we demonstrate that our method can recover both standard proximity-based communities and role-based groupings of nodes. In synthetic and real world data we show that it can compete with baseline techniques, while additionally providing interpretable abstractions of network dynamics.  ( 2 min )

We consider the problem of estimating the optimal transport map between two probability distributions, $P$ and $Q$ in $\mathbb R^d$, on the basis of i.i.d. samples. All existing statistical analyses of this problem require the assumption that the transport map is Lipschitz, a strong requirement that, in particular, excludes any examples where the transport map is discontinuous. As a first step towards developing estimation procedures for discontinuous maps, we consider the important special case where the data distribution $Q$ is a discrete measure supported on a finite number of points in $\mathbb R^d$. We study a computationally efficient estimator initially proposed by Pooladian and Niles-Weed (2021), based on entropic optimal transport, and show in the semi-discrete setting that it converges at the minimax-optimal rate $n^{-1/2}$, independent of dimension. Other standard map estimation techniques both lack finite-sample guarantees in this setting and provably suffer from the curse of dimensionality. We confirm these results in numerical experiments, and provide experiments for other settings, not covered by our theory, which indicate that the entropic estimator is a promising methodology for other discontinuous transport map estimation problems.  ( 2 min )

A directed acyclic graph (DAG) provides valuable prior knowledge that is often discarded in regression tasks in machine learning. We show that the independences arising from the presence of collider structures in DAGs provide meaningful inductive biases, which constrain the regression hypothesis space and improve predictive performance. We introduce collider regression, a framework to incorporate probabilistic causal knowledge from a collider in a regression problem. When the hypothesis space is a reproducing kernel Hilbert space, we prove a strictly positive generalisation benefit under mild assumptions and provide closed-form estimators of the empirical risk minimiser. Experiments on synthetic and climate model data demonstrate performance gains of the proposed methodology.  ( 2 min )

Recent advances in autonomous robotic technologies have highlighted the growing need for precise environmental analysis. LiDAR semantic segmentation has gained attention to accomplish fine-grained scene understanding by acting directly on raw content provided by sensors. Recent solutions showed how different learning techniques can be used to improve the performance of the model, without any architectural or dataset change. Following this trend, we present a coarse-to-fine setup that LEArns from classification mistaKes (LEAK) derived from a standard model. First, classes are clustered into macro groups according to mutual prediction errors; then, the learning process is regularized by: (1) aligning class-conditional prototypical feature representation for both fine and coarse classes, (2) weighting instances with a per-class fairness index. Our LEAK approach is very general and can be seamlessly applied on top of any segmentation architecture; indeed, experimental results showed that it enables state-of-the-art performances on different architectures, datasets and tasks, while ensuring more balanced class-wise results and faster convergence.  ( 2 min )

In this work, we consider learning sparse models in large scale settings, where the number of samples and the feature dimension can grow as large as millions or billions. Two immediate issues occur under such challenging scenario: (i) computational cost; (ii) memory overhead. In particular, the memory issue precludes a large volume of prior algorithms that are based on batch optimization technique. To remedy the problem, we propose to learn sparse models such as Lasso in an online manner where in each iteration, only one randomly chosen sample is revealed to update a sparse iterate. Thereby, the memory cost is independent of the sample size and gradient evaluation for one sample is efficient. Perhaps amazingly, we find that with the same parameter, sparsity promoted by batch methods is not preserved in online fashion. We analyze such interesting phenomenon and illustrate some effective variants including mini-batch methods and a hard thresholding based stochastic gradient algorithm. Extensive experiments are carried out on a public dataset which supports our findings and algorithms.  ( 2 min )

In this paper, we prove that separable negative log-likelihood losses for structured prediction are not necessarily Bayes consistent, or, in other words, minimizing these losses may not result in a model that predicts the most probable structure in the data distribution for a given input. This fact opens the question of whether these losses are well-adapted for structured prediction and, if so, why.  ( 2 min )

Currently, applying diffusion models in pixel space of high resolution images is difficult. Instead, existing approaches focus on diffusion in lower dimensional spaces (latent diffusion), or have multiple super-resolution levels of generation referred to as cascades. The downside is that these approaches add additional complexity to the diffusion framework. This paper aims to improve denoising diffusion for high resolution images while keeping the model as simple as possible. The paper is centered around the research question: How can one train a standard denoising diffusion models on high resolution images, and still obtain performance comparable to these alternate approaches? The four main findings are: 1) the noise schedule should be adjusted for high resolution images, 2) It is sufficient to scale only a particular part of the architecture, 3) dropout should be added at specific locations in the architecture, and 4) downsampling is an effective strategy to avoid high resolution feature maps. Combining these simple yet effective techniques, we achieve state-of-the-art on image generation among diffusion models without sampling modifiers on ImageNet.  ( 2 min )

In this paper we propose a novel and computationally efficient method to simultaneously achieve vertex embedding, community detection, and community size determination. By utilizing a normalized one-hot graph encoder and a new rank-based cluster size measure, the proposed graph encoder ensemble algorithm achieves excellent numerical performance throughout a variety of simulations and real data experiments.  ( 2 min )

We introduce a new class of spatially stochastic physics and data informed deep latent models for parametric partial differential equations (PDEs) which operate through scalable variational neural processes. We achieve this by assigning probability measures to the spatial domain, which allows us to treat collocation grids probabilistically as random variables to be marginalised out. Adapting this spatial statistics view, we solve forward and inverse problems for parametric PDEs in a way that leads to the construction of Gaussian process models of solution fields. The implementation of these random grids poses a unique set of challenges for inverse physics informed deep learning frameworks and we propose a new architecture called Grid Invariant Convolutional Networks (GICNets) to overcome these challenges. We further show how to incorporate noisy data in a principled manner into our physics informed model to improve predictions for problems where data may be available but whose measurement location does not coincide with any fixed mesh or grid. The proposed method is tested on a nonlinear Poisson problem, Burgers equation, and Navier-Stokes equations, and we provide extensive numerical comparisons. We demonstrate significant computational advantages over current physics informed neural learning methods for parametric PDEs while improving the predictive capabilities and flexibility of these models.  ( 2 min )

Risk-sensitive reinforcement learning (RL) has become a popular tool to control the risk of uncertain outcomes and ensure reliable performance in various sequential decision-making problems. While policy gradient methods have been developed for risk-sensitive RL, it remains unclear if these methods enjoy the same global convergence guarantees as in the risk-neutral case. In this paper, we consider a class of dynamic time-consistent risk measures, called Expected Conditional Risk Measures (ECRMs), and derive policy gradient updates for ECRM-based objective functions. Under both constrained direct parameterization and unconstrained softmax parameterization, we provide global convergence of the corresponding risk-averse policy gradient algorithms. We further test a risk-averse variant of REINFORCE algorithm on a stochastic Cliffwalk environment to demonstrate the efficacy of our algorithm and the importance of risk control.  ( 2 min )

Graph neural networks (GNNs) achieve remarkable performance in graph machine learning tasks but can be hard to train on large-graph data, where their learning dynamics are not well understood. We investigate the training dynamics of large-graph GNNs using graph neural tangent kernels (GNTKs) and graphons. In the limit of large width, optimization of an overparametrized NN is equivalent to kernel regression on the NTK. Here, we investigate how the GNTK evolves as another independent dimension is varied: the graph size. We use graphons to define limit objects -- graphon NNs for GNNs, and graphon NTKs for GNTKs, and prove that, on a sequence of growing graphs, the GNTKs converge to the graphon NTK. We further prove that the eigenspaces of the GNTK, which are related to the problem learning directions and associated learning speeds, converge to the spectrum of the GNTK. This implies that in the large-graph limit, the GNTK fitted on a graph of moderate size can be used to solve the same task on the large-graph and infer the learning dynamics of the large-graph GNN. These results are verified empirically on node regression and node classification tasks.  ( 2 min )

submitted by /u/Robinsonc1988 [link] [comments]  ( 40 min )

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Bright Eye: mobile AI app that generates art, code, poems, essays, short stories, answers questions, and more! Hey guys, I’m the cofounder of a tech startup focused on providing free AI services. We’re one of the first mobile multipurpose AI apps. We’ve developed a pretty cool app that offers AI services like image generation, code generation, image captioning, and more for free. We’re sort of like a Swiss Army knife of generative and analytical AI. We’ve released a new feature called AAIA(Ask AI Anything), which is capable of answering all types of questions, even requests to generate literature, storylines, answer questions and more, (think of chatgpt). We’d love to have some people try it out, give us feedback, and keep in touch with us. https://apps.apple.com/us/app/bright-eye/id1593932475 submitted by /u/SonnyDoge22 [link] [comments]  ( 41 min )

Before you quick draw shoot the messenger here, I want you to hear me out. This is coming from a person who enjoys drawing digital art and a person who used to make music for fun. Humans tend to be very selfish creatures, not in an evil sense, but rather a "phew, glad that was you and not me" sense, like if someone stepped in a pile of of dog poop that sucks for them, but it's not your problem. Once everybodies creative (not labor intenseive) livelyhoods get taken, then yeah, I could see how now AI replicating humanity could be a problem. Then maybe after that, people can enjoy not being replaced. That is all I have to say, god bless my reddit karma, I can feel this subreddit getting ready to dislike bomb this, but as long as this message gets out, that's all I want. submitted by /u/Zima_Re-L [link] [comments]  ( 41 min )

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I want to be able to upload several photos (10 - 100) and have the AI generate a video using those photos. I've seen Genmo, but that only uses one photo at a time. Is there anything that may be able to do this? Thanks submitted by /u/venicerocco [link] [comments]  ( 40 min )

submitted by /u/KTMark [link] [comments]  ( 40 min )

https://www.youtube.com/watch?v=Vw-t826JcDQ submitted by /u/Optimal_Studio_2050 [link] [comments]  ( 40 min )

Specifically this one: https://www.youtube.com/watch?v=MFv7apjatwM&ab_channel=Lux-Topic If there is no current AI that is able to listen to a song and write down the lyrics accurately, then I provide this idea freely. submitted by /u/A_Very_Horny_Zed [link] [comments]  ( 40 min )

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If ChatGPT and AI search engines become the central place for acquiring knowledge, essentially scraping and disintermediating websites; what commercial incentive will many website owners have to generate new content once their ad revenue is gone? What will happen to the internet? submitted by /u/DelPrive235 [link] [comments]  ( 41 min )

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I've just been wondering why people have been able to develop AI models such as GANs and more recently diffusion models that are so good at creating images but music generation has remained somewhat stagnant. From what I understand, there are two ways AI are generally trained on music: through MIDI files and using raw audio. The MIDI files are probably easier for the AI to work with but there's massive loss of relevant data that an AI would need to really become proficient in music generation. On the other hand, AIs trained on the raw audio tend to produce somewhat fuzzy audio that often includes what sounds like nearly distinguishable lyrics. I'm personally convinced the latter is the method that will be universally used in the future, but it clearly has a long way to go. So does anyone have any insights regarding why it's straggling a bit? Perhaps it's because software like Stable Diffusion are piggybacking off the image recognition advancements that have been in very high demand the past couple decades? Perhaps music is, in fact, a more complicated or more strict artform and our human minds are biased to think that these two tasks should be roughly equivalent in difficulty? It's certainly not due to a lack of data to train on, so maybe we just don't have a model that's really suited to analyzing and imitating music. submitted by /u/No-Phrase1116 [link] [comments]  ( 44 min )

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I was rendering 'MountainCar-v0' environment in "human" render_mode. When I call env.close(), my pygame window doesn't closes automatically and I need to Force Quit it, and unfortunately my kernel dies. I'm using Jupyter Notebook. Following are my versions: PC: Mac OS Ventura 13.1 - Python: Python 3.9.9 - Jupyter:jupyter 1.0.0 - gym: 0.26.2 - ipykernel: 6.6.0 - ipython: 7.30.1 ​ Please let me know how I can solve this issue, Thanks! submitted by /u/Character-Yellow-796 [link] [comments]  ( 41 min )

Hello everyone. I have a question about hyperparameter tuning for PPO. usually, when we tune them ( using Optuna for example), each set of hyperparameters is tested for a small number of steps ( 150000 for example ) then we pick the ones that yielded the best reward. Yet, in the long run, the asymptotic convergence might not be reached by the best hyperparameters found during tuning but rather, other hyperparameters that performed worse during tuning are the ones that might results in better asymptotic convergence. Is there any way to overcome this issue and maybe find the best hyperparameters without having to test for a large number of steps. Note: I'm using a custom environment with a continuous action space and image observations. submitted by /u/Many_Reception_4921 [link] [comments]  ( 42 min )

Hi, do you know papers that combine model-based and hierarchical reinforcement learning, where also the lower level is a model-based approach? I cannot find sufficient paper about it submitted by /u/aika98oe [link] [comments]  ( 42 min )

When a trained ML model is implemented to predict an adverse event, the user might take steps to avoid that event. The outcome of the user's actions could either be successful or failure. In training with strictly observational data, a typical confusion matrix contains: ŷ=0, y=0 -> True Negative ŷ=0, y=1 -> False Negative ŷ=1, y=1 -> True Positive ŷ=1, y=0 -> False Positive When using the model, some results get confounded if the user acts based on the predictions ŷ=0, y=0, a=0 -> True Negative, No Intervention ŷ=0, y=1, a=0 -> False Negative, No Intervention ŷ=1, y=1, a=1 -> True Positive, Failed Intervention ŷ=1, y=0, a=1 -> False Positive OR Successful Intervention Ignoring the possibility that the intervention caused the adverse event, the involvement of the user may lead to an increase in the number of false positives that are perceived. Continuous monitoring becomes difficult due to perceived faster degradation of the model. Furthermore, retraining the model in the future may be hindered by labels that do not accurately reflect the true values. One approach that I've been proposed is to make sure there is always a hold-out set. Allow some random records to get scores, but do never act on them. This gives both a monitoring and retraining dataset. Are there other solutions that people use here? I've found the papers below, but I cannot say that I completely understand how to practically implement them. Monitoring machine learning (ML)-based risk prediction algorithms in the presence of confounding medical interventions (https://arxiv.org/abs/2211.09781) Model updating after interventions paradoxically introduces bias (https://arxiv.org/abs/2010.11530) submitted by /u/waiting4omscs [link] [comments]  ( 43 min )

Hey! I am reading the GET3D paper by Nvidia. The paper is listed with the Nvidia license which states: 3.3 Use Limitation. The Work and any derivative works thereof only may be used or intended for use non-commercially. The Work or derivative works thereof may be used or intended for use by Nvidia or its affiliates commercially or non-commercially. As used herein, "non-commercially" means for research or evaluation purposes only and not for any direct or indirect monetary gain. Does it mean there is no commercial way of using the ideas in the paper? Is it possible to use the ideas from that paper or any other paper by Nvidia in some product? As the idea from the paper is only the tool or a part of the product but is not the product itself. submitted by /u/romantimm25 [link] [comments]  ( 44 min )

Has anyone got any interview email? Did they start the interview process? submitted by /u/Around-star [link] [comments]  ( 42 min )

I'm currently at the point in my PhD career that I've developed some extremely successful components of CNNs, architecture, activation, etc. Outperforming default choices on CIFAR10, CIFAR100, Flowers, Caltech101, and other smaller datasets. With how success the results currently are, we want to publish to a top tier conference, specifically NeurIPS this Spring, deadline around May 13th. However, we (me and my advisor) agree that to publish at NeurIPS, our developments need to be backed up by ImageNet. The problem is that we have never trained on ImageNet before (so no experience), and have a limited computational budget. Although our university personally owns 2 A100 40 GB GPUs that we can use, they are shared within the entire university, so a 2 day job takes about 1 week in queue (don't know if we can get the results in time by May). On the other hand, we also don't know if we can get a $2500 grant in time to use cloud resources. For those who have trained on ImageNet, what are some common pitfalls, best ways to transfer data, downloading the dataset, etc? If you performed it on the cloud, how did you do so? How long was your time to train? Expenses? Did you run each model once or three times? Early stopping using validation or test set? NOTE: We will only be using Tensorflow... submitted by /u/MyActualUserName99 [link] [comments]  ( 44 min )

I'd like to extract named entities, something like this: "[Text]: Microsoft (the word being a portmanteau of "microcomputer software") was founded by Bill Gates on April 4, 1975, to develop and sell BASIC interpreters for the Altair 8800. Steve Ballmer replaced Gates as CEO in 2000, and later envisioned a "devices and services" strategy. [Name]: Steve Ballmer [Position]: CEO [Company]: Microsoft " Tried it on GPT-Neox with 20b parameters with mixed success, is there anything better out there to try for a few-shot learning (without fine tuning)? submitted by /u/TankAttack [link] [comments]  ( 44 min )

Neuromorphic perception with event-based sensors, asynchronous hardware and spiking neurons is showing promising results for real-time and energy-efficient inference in embedded systems. The next promise of brain-inspired computing is to enable adaptation to changes at the edge with online learning. However, the parallel and distributed architectures of neuromorphic hardware based on co-localized compute and memory imposes locality constraints to the on-chip learning rules. We propose in this work the Event-based Three-factor Local Plasticity (ETLP) rule that uses (1) the pre-synaptic spike trace, (2) the post-synaptic membrane voltage and (3) a third factor in the form of projected labels with no error calculation, that also serve as update triggers. We apply ETLP with feedforward and recurrent spiking neural networks on visual and auditory event-based pattern recognition, and compare it to Back-Propagation Through Time (BPTT) and eProp. We show a competitive performance in accuracy with a clear advantage in the computational complexity for ETLP. We also show that when using local plasticity, threshold adaptation in spiking neurons and a recurrent topology are necessary to learn spatio-temporal patterns with a rich temporal structure. Finally, we provide a proof of concept hardware implementation of ETLP on FPGA to highlight the simplicity of its computational primitives and how they can be mapped into neuromorphic hardware for online learning with low-energy consumption and real-time interaction. Full paper: https://arxiv.org/abs/2301.08281 submitted by /u/ferquinve [link] [comments]  ( 43 min )

How far do you think this can go? Is it a memorization machine or can it create new songs? https://google-research.github.io/seanet/musiclm/examples/ submitted by /u/carlthome [link] [comments]  ( 44 min )

Large Language Models (LLMs) from the Generative Pretrained Transformer (GPT) family have shown remarkable performance on a wide range of tasks, but are difficult to deploy because of their massive size and computational costs. For instance, the top-performing GPT-175B model has 175 billion parameters, which total at least 320GB (counting multiples of 1024) of storage in half-precision (FP16) format, leading it to require at least five A100 GPUs with 80GB of memory each for inference. It is therefore natural that there has been significant interest in reducing these costs via model compression. To date, virtually all existing GPT compression approaches have focused on quantization, that is, reducing the precision of the numerical representation of individual weights. A complementary approa…  ( 47 min )

Now that apps are closed did anyone hear back yet? please follow this thread and update your status below, tbh I don't really think I have much of a chance but I'm excited none the less. ​ to follow a thread please press the bell on the top right submitted by /u/BeautyInUgly [link] [comments]  ( 42 min )

Edit: as has been explained in the comments, unicode is not the issue so much as the byte-pair encoding scheme, which artificially limits the vocabulary size of the model and leads to less common language using more tokens. I'd like to discuss the impacts of increasing the vocabulary size on transformer model computational requirements. Many languages, like Chinese, Japanese Kanji, Korean, Telugu, etc use complex logograms to represent words and concepts. Unfortunately, these languages are severely "punished" in GPT3 because they are expensive to tokenize due to the way unicode represents them. Instead of unicode representing them as a single code point, logograms are typically represented as a sum of multiple graphemes, meaning that multiple unicode code points underlie their descriptio…  ( 49 min )

I'm new to CTC. After learning about CTC and its application in End2End training for Speech Recognition, I figured that if we want to generate a target sequence (transcript), given a source sequence features, we could use the vanilla Encoder-Decoder architecture in Transformer (also used in T5, BART, etc) alone, without the need of CTC, yet why people are only using CTC for End2End Speech Recoginition, or using hybrid of CTC and Decoder in some papers ? Thanks. submitted by /u/KarmaCut132 [link] [comments]  ( 43 min )

One of the reasons why many neural networks are capable of replicating complicated tasks or functions is their universal property. Though the past few decades have seen tremendous advances in theories of neural networks, a single constructive framework for neural network universality remains unavailable. This paper is the first effort to provide a unified and constructive framework for the universality of a large class of activation functions including most of existing ones. At the heart of the framework is the concept of neural network approximate identity (nAI). The main result is: {\em any nAI activation function is universal}. It turns out that most of existing activation functions are nAI, and thus universal in the space of continuous functions on compacta. The framework induces {\bf several advantages} over the contemporary counterparts. First, it is constructive with elementary means from functional analysis, probability theory, and numerical analysis. Second, it is the first unified attempt that is valid for most of existing activation functions. Third, as a by product, the framework provides the first universality proof for some of the existing activation functions including Mish, SiLU, ELU, GELU, and etc. Fourth, it provides new proofs for most activation functions. Fifth, it discovers new activation functions with guaranteed universality property. Sixth, for a given activation and error tolerance, the framework provides precisely the architecture of the corresponding one-hidden neural network with predetermined number of neurons, and the values of weights/biases. Seventh, the framework allows us to abstractly present the first universal approximation with favorable non-asymptotic rate.  ( 3 min )

Long-tailed relation classification is a challenging problem as the head classes may dominate the training phase, thereby leading to the deterioration of the tail performance. Existing solutions usually address this issue via class-balancing strategies, e.g., data re-sampling and loss re-weighting, but all these methods adhere to the schema of entangling learning of the representation and classifier. In this study, we conduct an in-depth empirical investigation into the long-tailed problem and found that pre-trained models with instance-balanced sampling already capture the well-learned representations for all classes; moreover, it is possible to achieve better long-tailed classification ability at low cost by only adjusting the classifier. Inspired by this observation, we propose a robust classifier with attentive relation routing, which assigns soft weights by automatically aggregating the relations. Extensive experiments on two datasets demonstrate the effectiveness of our proposed approach. Code and datasets are available in https://github.com/zjunlp/deepke.  ( 2 min )

Triple extraction is an essential task in information extraction for natural language processing and knowledge graph construction. In this paper, we revisit the end-to-end triple extraction task for sequence generation. Since generative triple extraction may struggle to capture long-term dependencies and generate unfaithful triples, we introduce a novel model, contrastive triple extraction with a generative transformer. Specifically, we introduce a single shared transformer module for encoder-decoder-based generation. To generate faithful results, we propose a novel triplet contrastive training object. Moreover, we introduce two mechanisms to further improve model performance (i.e., batch-wise dynamic attention-masking and triple-wise calibration). Experimental results on three datasets (i.e., NYT, WebNLG, and MIE) show that our approach achieves better performance than that of baselines.  ( 2 min )

Modeling multi-agent systems requires understanding how agents interact. Such systems are often difficult to model because they can involve a variety of types of interactions that layer together to drive rich social behavioral dynamics. Here we introduce a method for accurately modeling multi-agent systems. We present Interaction Modeling with Multiplex Attention (IMMA), a forward prediction model that uses a multiplex latent graph to represent multiple independent types of interactions and attention to account for relations of different strengths. We also introduce Progressive Layer Training, a training strategy for this architecture. We show that our approach outperforms state-of-the-art models in trajectory forecasting and relation inference, spanning three multi-agent scenarios: social navigation, cooperative task achievement, and team sports. We further demonstrate that our approach can improve zero-shot generalization and allows us to probe how different interactions impact agent behavior.  ( 2 min )

The brains of all bilaterally symmetric animals on Earth are divided into left and right hemispheres. The anatomy and functionality of the hemispheres have a large degree of overlap, but there are asymmetries and they specialize to possess different attributes. Several studies have used computational models to mimic hemispheric asymmetries with a focus on reproducing human data on semantic and visual processing tasks. In this study, we aimed to understand how dual hemispheres could interact in a given task. We propose a bilateral artificial neural network that imitates a lateralization observed in nature: that the left hemisphere specializes in specificity and the right in generalities. We used two ResNet-9 convolutional neural networks with different training objectives and tested it on an image classification task. Our analysis found that the hemispheres represent complementary features that are exploited by a network head which implements a type of weighted attention. The bilateral architecture outperformed a range of baselines of similar representational capacity that don't exploit differential specialization. The results demonstrate the efficacy of bilateralism, contribute to an understanding of bilateralism in biological brains and the architecture serves as an inductive bias when designing new AI systems.  ( 2 min )

We propose a distance supervised relation extraction approach for long-tailed, imbalanced data which is prevalent in real-world settings. Here, the challenge is to learn accurate "few-shot" models for classes existing at the tail of the class distribution, for which little data is available. Inspired by the rich semantic correlations between classes at the long tail and those at the head, we take advantage of the knowledge from data-rich classes at the head of the distribution to boost the performance of the data-poor classes at the tail. First, we propose to leverage implicit relational knowledge among class labels from knowledge graph embeddings and learn explicit relational knowledge using graph convolution networks. Second, we integrate that relational knowledge into relation extraction model by coarse-to-fine knowledge-aware attention mechanism. We demonstrate our results for a large-scale benchmark dataset which show that our approach significantly outperforms other baselines, especially for long-tail relations.  ( 2 min )

To mitigate climate change, the share of renewable energies in power production needs to be increased. Renewables introduce new challenges to power grids regarding the dynamic stability due to decentralization, reduced inertia and volatility in production. Since dynamic stability simulations are intractable and exceedingly expensive for large grids, graph neural networks (GNNs) are a promising method to reduce the computational effort of analyzing dynamic stability of power grids. We provide new datasets of dynamic stability of synthetic power grids and find that GNNs are surprisingly effective at predicting the highly non-linear targets from topological information only. Furthermore, we use GNNs to demonstrate the accurate identification of particularly vulnerable nodes in power grids, so-called troublemakers. Lastly, we find that GNNs trained on small grids generate accurate predictions on a large synthetic model of the Texan power grid, which illustrates the potential for real-world applications of the presented approach.  ( 2 min )

Recently, pseudo label based semi-supervised learning has achieved great success in many fields. The core idea of the pseudo label based semi-supervised learning algorithm is to use the model trained on the labeled data to generate pseudo labels on the unlabeled data, and then train a model to fit the previously generated pseudo labels. We give a theory analysis for why pseudo label based semi-supervised learning is effective in this paper. We mainly compare the generalization error of the model trained under two settings: (1) There are N labeled data. (2) There are N unlabeled data and a suitable initial model. Our analysis shows that, firstly, when the amount of unlabeled data tends to infinity, the pseudo label based semi-supervised learning algorithm can obtain model which have the same generalization error upper bound as model obtained by normally training in the condition of the amount of labeled data tends to infinity. More importantly, we prove that when the amount of unlabeled data is large enough, the generalization error upper bound of the model obtained by pseudo label based semi-supervised learning algorithm can converge to the optimal upper bound with linear convergence rate. We also give the lower bound on sampling complexity to achieve linear convergence rate. Our analysis contributes to understanding the empirical successes of pseudo label-based semi-supervised learning.  ( 2 min )

This paper presents our systems for the three Subtasks of SemEval Task4: Reading Comprehension of Abstract Meaning (ReCAM). We explain the algorithms used to learn our models and the process of tuning the algorithms and selecting the best model. Inspired by the similarity of the ReCAM task and the language pre-training, we propose a simple yet effective technology, namely, negative augmentation with language model. Evaluation results demonstrate the effectiveness of our proposed approach. Our models achieve the 4th rank on both official test sets of Subtask 1 and Subtask 2 with an accuracy of 87.9% and an accuracy of 92.8%, respectively. We further conduct comprehensive model analysis and observe interesting error cases, which may promote future researches.  ( 2 min )

We present a physics-enhanced implicit neural representation (INR) for ultrasound (US) imaging that learns tissue properties from overlapping US sweeps. Our proposed method leverages a ray-tracing-based neural rendering for novel view US synthesis. Recent publications demonstrated that INR models could encode a representation of a three-dimensional scene from a set of two-dimensional US frames. However, these models fail to consider the view-dependent changes in appearance and geometry intrinsic to US imaging. In our work, we discuss direction-dependent changes in the scene and show that a physics-inspired rendering improves the fidelity of US image synthesis. In particular, we demonstrate experimentally that our proposed method generates geometrically accurate B-mode images for regions with ambiguous representation owing to view-dependent differences of the US images. We conduct our experiments using simulated B-mode US sweeps of the liver and acquired US sweeps of a spine phantom tracked with a robotic arm. The experiments corroborate that our method generates US frames that enable consistent volume compounding from previously unseen views. To the best of our knowledge, the presented work is the first to address view-dependent US image synthesis using INR.

Large-scale pre-trained language models have contributed significantly to natural language processing by demonstrating remarkable abilities as few-shot learners. However, their effectiveness depends mainly on scaling the model parameters and prompt design, hindering their implementation in most real-world applications. This study proposes a novel pluggable, extensible, and efficient approach named DifferentiAble pRompT (DART), which can convert small language models into better few-shot learners without any prompt engineering. The main principle behind this approach involves reformulating potential natural language processing tasks into the task of a pre-trained language model and differentially optimizing the prompt template as well as the target label with backpropagation. Furthermore, the proposed approach can be: (i) Plugged to any pre-trained language models; (ii) Extended to widespread classification tasks. A comprehensive evaluation of standard NLP tasks demonstrates that the proposed approach achieves a better few-shot performance. Code is available in https://github.com/zjunlp/DART.

Knowledge Graphs (KGs) often have two characteristics: heterogeneous graph structure and text-rich entity/relation information. KG representation models should consider graph structures and text semantics, but no comprehensive open-sourced framework is mainly designed for KG regarding informative text description. In this paper, we present PromptKG, a prompt learning framework for KG representation learning and application that equips the cutting-edge text-based methods, integrates a new prompt learning model and supports various tasks (e.g., knowledge graph completion, question answering, recommendation, and knowledge probing). PromptKG is publicly open-sourced at https://github.com/zjunlp/PromptKG with long-term technical support.

Biomedical text mining is becoming increasingly important as the number of biomedical documents and web data rapidly grows. Recently, word representation models such as BERT has gained popularity among researchers. However, it is difficult to estimate their performance on datasets containing biomedical texts as the word distributions of general and biomedical corpora are quite different. Moreover, the medical domain has long-tail concepts and terminologies that are difficult to be learned via language models. For the Chinese biomedical text, it is more difficult due to its complex structure and the variety of phrase combinations. In this paper, we investigate how the recently introduced pre-trained language model BERT can be adapted for Chinese biomedical corpora and propose a novel conceptualized representation learning approach. We also release a new Chinese Biomedical Language Understanding Evaluation benchmark (\textbf{ChineseBLUE}). We examine the effectiveness of Chinese pre-trained models: BERT, BERT-wwm, RoBERTa, and our approach. Experimental results on the benchmark show that our approach could bring significant gain. We release the pre-trained model on GitHub: https://github.com/alibaba-research/ChineseBLUE.

Recent neural-based relation extraction approaches, though achieving promising improvement on benchmark datasets, have reported their vulnerability towards adversarial attacks. Thus far, efforts mostly focused on generating adversarial samples or defending adversarial attacks, but little is known about the difference between normal and adversarial samples. In this work, we take the first step to leverage the salience-based method to analyze those adversarial samples. We observe that salience tokens have a direct correlation with adversarial perturbations. We further find the adversarial perturbations are either those tokens not existing in the training set or superficial cues associated with relation labels. To some extent, our approach unveils the characters against adversarial samples. We release an open-source testbed, "DiagnoseAdv" in https://github.com/zjunlp/DiagnoseAdv.

Previous knowledge graph embedding approaches usually map entities to representations and utilize score functions to predict the target entities, yet they struggle to reason rare or emerging unseen entities. In this paper, we propose kNN-KGE, a new knowledge graph embedding approach with pre-trained language models, by linearly interpolating its entity distribution with k-nearest neighbors. We compute the nearest neighbors based on the distance in the entity embedding space from the knowledge store. Our approach can allow rare or emerging entities to be memorized explicitly rather than implicitly in model parameters. Experimental results demonstrate that our approach can improve inductive and transductive link prediction results and yield better performance for low-resource settings with only a few triples, which might be easier to reason via explicit memory. Code is available at https://github.com/zjunlp/KNN-KG.

Methods to certify the robustness of neural networks in the presence of input uncertainty are vital in safety-critical settings. Most certification methods in the literature are designed for adversarial or worst-case inputs, but researchers have recently shown a need for methods that consider random input noise. In this paper, we examine the setting where inputs are subject to random noise coming from an arbitrary probability distribution. We propose a robustness certification method that lower-bounds the probability that network outputs are safe. This bound is cast as a chance-constrained optimization problem, which is then reformulated using input-output samples to make the optimization constraints tractable. We develop sufficient conditions for the resulting optimization to be convex, as well as on the number of samples needed to make the robustness bound hold with overwhelming probability. We show for a special case that the proposed optimization reduces to an intuitive closed-form solution. Case studies on synthetic, MNIST, and CIFAR-10 networks experimentally demonstrate that this method is able to certify robustness against various input noise regimes over larger uncertainty regions than prior state-of-the-art techniques.

The last decade witnessed an ever-increasing stream of successes in Machine Learning (ML). These successes offer clear evidence that ML is bound to become pervasive in a wide range of practical uses, including many that directly affect humans. Unfortunately, the operation of the most successful ML models is incomprehensible for human decision makers. As a result, the use of ML models, especially in high-risk and safety-critical settings is not without concern. In recent years, there have been efforts on devising approaches for explaining ML models. Most of these efforts have focused on so-called model-agnostic approaches. However, all model-agnostic and related approaches offer no guarantees of rigor, hence being referred to as non-formal. For example, such non-formal explanations can be consistent with different predictions, which renders them useless in practice. This paper overviews the ongoing research efforts on computing rigorous model-based explanations of ML models; these being referred to as formal explanations. These efforts encompass a variety of topics, that include the actual definitions of explanations, the characterization of the complexity of computing explanations, the currently best logical encodings for reasoning about different ML models, and also how to make explanations interpretable for human decision makers, among others.

Although the self-supervised pre-training of transformer models has resulted in the revolutionizing of natural language processing (NLP) applications and the achievement of state-of-the-art results with regard to various benchmarks, this process is still vulnerable to small and imperceptible permutations originating from legitimate inputs. Intuitively, the representations should be similar in the feature space with subtle input permutations, while large variations occur with different meanings. This motivates us to investigate the learning of robust textual representation in a contrastive manner. However, it is non-trivial to obtain opposing semantic instances for textual samples. In this study, we propose a disentangled contrastive learning method that separately optimizes the uniformity and alignment of representations without negative sampling. Specifically, we introduce the concept of momentum representation consistency to align features and leverage power normalization while conforming the uniformity. Our experimental results for the NLP benchmarks demonstrate that our approach can obtain better results compared with the baselines, as well as achieve promising improvements with invariance tests and adversarial attacks. The code is available in https://github.com/zxlzr/DCL.

It has been considered that urban air mobility (UAM), also known as drone-taxi or electrical vertical takeoff and landing (eVTOL), will play a key role in future transportation. By putting UAM into practical future transportation, several benefits can be realized, i.e., (i) the total travel time of passengers can be reduced compared to traditional transportation and (ii) there is no environmental pollution and no special labor costs to operate the system because electric batteries will be used in UAM system. However, there are various dynamic and uncertain factors in the flight environment, i.e., passenger sudden service requests, battery discharge, and collision among UAMs. Therefore, this paper proposes a novel cooperative MADRL algorithm based on centralized training and distributed execution (CTDE) concepts for reliable and efficient passenger delivery in UAM networks. According to the performance evaluation results, we confirm that the proposed algorithm outperforms other existing algorithms in terms of the number of serviced passengers increase (30%) and the waiting time per serviced passenger decrease (26%).

We propose a novel method to model hierarchical metrical structures for both symbolic music and audio signals in a self-supervised manner with minimal domain knowledge. The model trains and inferences on beat-aligned music signals and predicts an 8-layer hierarchical metrical tree from beat, measure to the section level. The training procedure does not require any hierarchical metrical labeling except for beats, purely relying on the nature of metrical regularity and inter-voice consistency as inductive biases. We show in experiments that the method achieves comparable performance with supervised baselines on multiple metrical structure analysis tasks on both symbolic music and audio signals. All demos, source code and pre-trained models are publicly available on GitHub.

Fine-tuning pre-trained models have achieved impressive performance on standard natural language processing benchmarks. However, the resultant model generalizability remains poorly understood. We do not know, for example, how excellent performance can lead to the perfection of generalization models. In this study, we analyze a fine-tuned BERT model from different perspectives using relation extraction. We also characterize the differences in generalization techniques according to our proposed improvements. From empirical experimentation, we find that BERT suffers a bottleneck in terms of robustness by way of randomizations, adversarial and counterfactual tests, and biases (i.e., selection and semantic). These findings highlight opportunities for future improvements. Our open-sourced testbed DiagnoseRE is available in \url{https://github.com/zjunlp/DiagnoseRE}.

Recent days have witnessed a diverse set of knowledge injection models for pre-trained language models (PTMs); however, most previous studies neglect the PTMs' own ability with quantities of implicit knowledge stored in parameters. A recent study has observed knowledge neurons in the Feed Forward Network (FFN), which are responsible for expressing factual knowledge. In this work, we propose a simple model, Kformer, which takes advantage of the knowledge stored in PTMs and external knowledge via knowledge injection in Transformer FFN layers. Empirically results on two knowledge-intensive tasks, commonsense reasoning (i.e., SocialIQA) and medical question answering (i.e., MedQA-USMLE), demonstrate that Kformer can yield better performance than other knowledge injection technologies such as concatenation or attention-based injection. We think the proposed simple model and empirical findings may be helpful for the community to develop more powerful knowledge injection methods. Code available in https://github.com/zjunlp/Kformer.

A Top Two sampling rule for bandit identification is a method which selects the next arm to sample from among two candidate arms, a leader and a challenger. Due to their simplicity and good empirical performance, they have received increased attention in recent years. However, for fixed-confidence best arm identification, theoretical guarantees for Top Two methods have only been obtained in the asymptotic regime, when the error level vanishes. In this paper, we derive the first non-asymptotic upper bound on the expected sample complexity of a Top Two algorithm, which holds for any error level. Our analysis highlights sufficient properties for a regret minimization algorithm to be used as leader. These properties are satisfied by the UCB algorithm, and our proposed UCB-based Top Two algorithm simultaneously enjoys non-asymptotic guarantees and competitive empirical performance.

The explainability of Graph Neural Networks (GNNs) is critical to various GNN applications but remains an open challenge. A convincing explanation should be both necessary and sufficient simultaneously. However, existing GNN explaining approaches focus on only one of the two aspects, necessity or sufficiency, or a heuristic trade-off between the two. Theoretically, the Probability of Necessity and Sufficiency (PNS) can be applied to search for the most necessary and sufficient explanation since it can mathematically quantify the necessity and sufficiency of an explanation. Nevertheless, the difficulty of obtaining PNS due to non-monotonicity and the challenge of counterfactual estimation limit its wide use. To address the non-identifiability of PNS, we resort to a lower bound of PNS that can be optimized via counterfactual estimation, and propose Necessary and Sufficient Explanation for GNN (NSEG) via optimizing that lower bound. Specifically, we employ nearest neighbor matching to generate counterfactual samples and leverage continuous masks with a sampling strategy to optimize the lower bound. Empirical study shows that NSEG achieves excellent performance in generating the most necessary and sufficient explanations among a series of state-of-the-art methods.

Event argument extraction (EAE) is an important task for information extraction to discover specific argument roles. In this study, we cast EAE as a question-based cloze task and empirically analyze fixed discrete token template performance. As generating human-annotated question templates is often time-consuming and labor-intensive, we further propose a novel approach called "Learning to Ask," which can learn optimized question templates for EAE without human annotations. Experiments using the ACE-2005 dataset demonstrate that our method based on optimized questions achieves state-of-the-art performance in both the few-shot and supervised settings.